N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide

C342H361BrCl2N74O40S2 — CID 159582071

IUPACN-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide
SMILESCN(C(=O)C(C)(C)c1ccccc1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)C1CC(=O)NC(=O)C1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)nc1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)s1)n2CCC(N)=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)s1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(Cl)cc1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccnc(Cl)c1)n2CCC(N)=O.CN(C(=O)Cc1c[nH]c2ccccc12)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)Cc1cccc2ccccc12)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.COc1ccc(C(=O)Nc2nc3cc(N(C)C(=O)CC4CCCC4)ccc3n2CCC(N)=O)cc1OCc1ccccc1.Cc1nn(Cc2cccc(C(=O)Nc3nc4cc(N(C)C(=O)CC5CCCC5)ccc4n3CCC(N)=O)c2)c(C)c1Br
InChIInChI=1S/C33H37N5O5.C31H36BrN7O3.C31H26N6O3.C30H34N6O3.C29H34ClN5O3.C29H33N7O3.C29H25N7O3.C29H28N6O3.C28H32N6O3S.C25H23N7O5.C24H27ClN6O3.C24H26N6O3S/c1-37(31(40)18-22-8-6-7-9-22)25-13-14-27-26(20-25)35-33(38(27)17-16-30(34)39)36-32(41)24-12-15-28(42-2)29(19-24)43-21-23-10-4-3-5-11-23;1-19-29(32)20(2)39(36-19)18-22-9-6-10-23(15-22)30(42)35-31-34-25-17-24(11-12-26(25)38(31)14-13-27(33)40)37(3)28(41)16-21-7-4-5-8-21;1-36(29(39)17-23-7-4-6-21-5-2-3-8-25(21)23)24-13-14-27-26(18-24)34-31(37(27)16-15-28(33)38)35-30(40)22-11-9-20(19-32)10-12-22;1-34(28(38)18-21-6-2-3-7-21)24-13-14-26-25(19-24)32-30(33-29(39)23-11-9-22(20-31)10-12-23)36(26)17-5-16-35-15-4-8-27(35)37;1-33(27(37)18-20-6-2-3-7-20)23-13-14-25-24(19-23)31-29(32-28(38)21-9-11-22(30)12-10-21)35(25)17-5-16-34-15-4-8-26(34)36;1-34(27(38)16-20-6-2-3-7-20)23-11-12-25-24(17-23)32-29(33-28(39)21-9-10-22(18-30)31-19-21)36(25)15-5-14-35-13-4-8-26(35)37;1-35(27(38)14-20-17-32-23-5-3-2-4-22(20)23)21-10-11-25-24(15-21)33-29(36(25)13-12-26(31)37)34-28(39)19-8-6-18(16-30)7-9-19;1-29(2,21-7-5-4-6-8-21)27(38)34(3)22-13-14-24-23(17-22)32-28(35(24)16-15-25(31)36)33-26(37)20-11-9-19(18-30)10-12-20;1-32(26(36)16-19-6-2-3-7-19)20-9-11-23-22(17-20)30-28(31-27(37)24-12-10-21(18-29)38-24)34(23)15-5-14-33-13-4-8-25(33)35;1-31(24(37)16-10-21(34)29-22(35)11-16)17-6-7-19-18(12-17)28-25(32(19)9-8-20(27)33)30-23(36)15-4-2-14(13-26)3-5-15;1-30(22(33)12-15-4-2-3-5-15)17-6-7-19-18(14-17)28-24(31(19)11-9-21(26)32)29-23(34)16-8-10-27-20(25)13-16;1-29(22(32)12-15-4-2-3-5-15)16-6-8-19-18(13-16)27-24(30(19)11-10-21(26)31)28-23(33)20-9-7-17(14-25)34-20/h3-5,10-15,19-20,22H,6-9,16-18,21H2,1-2H3,(H2,34,39)(H,35,36,41);6,9-12,15,17,21H,4-5,7-8,13-14,16,18H2,1-3H3,(H2,33,40)(H,34,35,42);2-14,18H,15-17H2,1H3,(H2,33,38)(H,34,35,40);9-14,19,21H,2-8,15-18H2,1H3,(H,32,33,39);9-14,19-20H,2-8,15-18H2,1H3,(H,31,32,38);9-12,17,19-20H,2-8,13-16H2,1H3,(H,32,33,39);2-11,15,17,32H,12-14H2,1H3,(H2,31,37)(H,33,34,39);4-14,17H,15-16H2,1-3H3,(H2,31,36)(H,32,33,37);9-12,17,19H,2-8,13-16H2,1H3,(H,30,31,37);2-7,12,16H,8-11H2,1H3,(H2,27,33)(H,28,30,36)(H,29,34,35);6-8,10,13-15H,2-5,9,11-12H2,1H3,(H2,26,32)(H,28,29,34);6-9,13,15H,2-5,10-12H2,1H3,(H2,26,31)(H,27,28,33)
InChIKeyMJDJIWMBQBGYTA-UHFFFAOYSA-N
MW6363.07 g/mol
LogP50.27
Rot. Bonds105

About N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide

N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide (PubChem CID 159582071) has the molecular formula C342H361BrCl2N74O40S2 and a molecular weight of 6363.07 g/mol. Its IUPAC name is N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide
PubChem CID159582071
Molecular FormulaC342H361BrCl2N74O40S2
Molecular Weight6363.07 g/mol
Exact Mass6356.65
IUPAC NameN-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide
SMILESCN(C(=O)C(C)(C)c1ccccc1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)C1CC(=O)NC(=O)C1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)nc1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)s1)n2CCC(N)=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)s1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(Cl)cc1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccnc(Cl)c1)n2CCC(N)=O.CN(C(=O)Cc1c[nH]c2ccccc12)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)Cc1cccc2ccccc12)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.COc1ccc(C(=O)Nc2nc3cc(N(C)C(=O)CC4CCCC4)ccc3n2CCC(N)=O)cc1OCc1ccccc1.Cc1nn(Cc2cccc(C(=O)Nc3nc4cc(N(C)C(=O)CC5CCCC5)ccc4n3CCC(N)=O)c2)c(C)c1Br
InChIInChI=1S/C33H37N5O5.C31H36BrN7O3.C31H26N6O3.C30H34N6O3.C29H34ClN5O3.C29H33N7O3.C29H25N7O3.C29H28N6O3.C28H32N6O3S.C25H23N7O5.C24H27ClN6O3.C24H26N6O3S/c1-37(31(40)18-22-8-6-7-9-22)25-13-14-27-26(20-25)35-33(38(27)17-16-30(34)39)36-32(41)24-12-15-28(42-2)29(19-24)43-21-23-10-4-3-5-11-23;1-19-29(32)20(2)39(36-19)18-22-9-6-10-23(15-22)30(42)35-31-34-25-17-24(11-12-26(25)38(31)14-13-27(33)40)37(3)28(41)16-21-7-4-5-8-21;1-36(29(39)17-23-7-4-6-21-5-2-3-8-25(21)23)24-13-14-27-26(18-24)34-31(37(27)16-15-28(33)38)35-30(40)22-11-9-20(19-32)10-12-22;1-34(28(38)18-21-6-2-3-7-21)24-13-14-26-25(19-24)32-30(33-29(39)23-11-9-22(20-31)10-12-23)36(26)17-5-16-35-15-4-8-27(35)37;1-33(27(37)18-20-6-2-3-7-20)23-13-14-25-24(19-23)31-29(32-28(38)21-9-11-22(30)12-10-21)35(25)17-5-16-34-15-4-8-26(34)36;1-34(27(38)16-20-6-2-3-7-20)23-11-12-25-24(17-23)32-29(33-28(39)21-9-10-22(18-30)31-19-21)36(25)15-5-14-35-13-4-8-26(35)37;1-35(27(38)14-20-17-32-23-5-3-2-4-22(20)23)21-10-11-25-24(15-21)33-29(36(25)13-12-26(31)37)34-28(39)19-8-6-18(16-30)7-9-19;1-29(2,21-7-5-4-6-8-21)27(38)34(3)22-13-14-24-23(17-22)32-28(35(24)16-15-25(31)36)33-26(37)20-11-9-19(18-30)10-12-20;1-32(26(36)16-19-6-2-3-7-19)20-9-11-23-22(17-20)30-28(31-27(37)24-12-10-21(18-29)38-24)34(23)15-5-14-33-13-4-8-25(33)35;1-31(24(37)16-10-21(34)29-22(35)11-16)17-6-7-19-18(12-17)28-25(32(19)9-8-20(27)33)30-23(36)15-4-2-14(13-26)3-5-15;1-30(22(33)12-15-4-2-3-5-15)17-6-7-19-18(14-17)28-24(31(19)11-9-21(26)32)29-23(34)16-8-10-27-20(25)13-16;1-29(22(32)12-15-4-2-3-5-15)16-6-8-19-18(13-16)27-24(30(19)11-10-21(26)31)28-23(33)20-9-7-17(14-25)34-20/h3-5,10-15,19-20,22H,6-9,16-18,21H2,1-2H3,(H2,34,39)(H,35,36,41);6,9-12,15,17,21H,4-5,7-8,13-14,16,18H2,1-3H3,(H2,33,40)(H,34,35,42);2-14,18H,15-17H2,1H3,(H2,33,38)(H,34,35,40);9-14,19,21H,2-8,15-18H2,1H3,(H,32,33,39);9-14,19-20H,2-8,15-18H2,1H3,(H,31,32,38);9-12,17,19-20H,2-8,13-16H2,1H3,(H,32,33,39);2-11,15,17,32H,12-14H2,1H3,(H2,31,37)(H,33,34,39);4-14,17H,15-16H2,1-3H3,(H2,31,36)(H,32,33,37);9-12,17,19H,2-8,13-16H2,1H3,(H,30,31,37);2-7,12,16H,8-11H2,1H3,(H2,27,33)(H,28,30,36)(H,29,34,35);6-8,10,13-15H,2-5,9,11-12H2,1H3,(H2,26,32)(H,28,29,34);6-9,13,15H,2-5,10-12H2,1H3,(H2,26,31)(H,27,28,33)
InChIKeyMJDJIWMBQBGYTA-UHFFFAOYSA-N
XLogP50.27
TPSA1547.06 Ų
H-Bond Donors22
H-Bond Acceptors78
Rotatable Bonds105
Heavy Atoms461
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006363.07
LogP ≤ 550.27
H-Bond Donors ≤ 522
H-Bond Acceptors ≤ 1078

Analyze N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide with MolForge

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Related Compounds

N-[1-(3-amino-3-oxopropyl)-5-[cyclohexanecarbonyl(methyl)amino]benzimidazol-2-yl]-6-cyanopyridine-3-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclohexanecarbonyl(methyl)amino]benzimidazol-2-yl]thiophene-2-carboxamide;4-bromo-N-[1-butyl-5-[cyclohexanecarbonyl(methyl)amino]benzimidazol-2-yl]benzamide;tert-butyl 4-[2-[2-[(4-cyanobenzoyl)amino]-5-[cyclohexanecarbonyl(methyl)amino]benzimidazol-1-yl]ethyl]piperazine-1-carboxylate;N-[1-butyl-5-[cyclohexanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-methylsulfonylbenzamide;3-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-(3-methoxypropyl)benzimidazol-2-yl]benzamide;3-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide
CID 160719892
N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-3-(hydroxymethyl)benzamide
CID 58742704
N-[1-(3-amino-3-oxopropyl)-5-[[cyclohexyl(methyl)amino]methyl]benzimidazol-2-yl]thiophene-2-carboxamide;4-chloro-N-[5-[[cyclohexyl(methyl)amino]methyl]-1-(3-methoxypropyl)benzimidazol-2-yl]benzamide;3-[2-[(4-cyanobenzoyl)amino]-5-[[cyclohexyl(methyl)amino]methyl]benzimidazol-1-yl]propyl acetate;4-cyano-N-[5-[[cyclohexyl(methyl)amino]methyl]-1-(3-hydroxypropyl)benzimidazol-2-yl]benzamide;3-cyano-N-[5-[[cyclohexyl(methyl)amino]methyl]-1-(3-methoxypropyl)benzimidazol-2-yl]benzamide;4-cyano-N-[5-[[cyclohexyl(methyl)amino]methyl]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide
CID 161147403
N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-4-[(E)-2-cyanoethenyl]benzamide;1-N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-3-N,3-N-dimethylbenzene-1,3-dicarboxamide;N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-3-(1,3-dioxolan-2-ylmethyl)benzamide;3-N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-1-N-[(4-fluorophenyl)methyl]benzene-1,3-dicarboxamide;N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-3-(2-hydroxyethyl)benzamide;3-N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-1-N-methylbenzene-1,3-dicarboxamide;N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-4-[(Z)-2-phenylethenyl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-(2-pyridin-3-ylethyl)benzimidazol-2-yl]benzamide;methyl 5-[[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]carbamoyl]thiophene-2-carboxylate
CID 158848106
N-[1-[3-[acetyl(ethyl)amino]propyl]-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-[3-[acetyl(methyl)amino]propyl]-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-bromobenzamide;N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-3-ethenylbenzamide;N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-4-ethylbenzamide;N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-4-(2-methoxyethyl)benzamide;N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-3-oxo-1,2-dihydroindene-5-carboxamide;5-[2-[2-[(4-cyanobenzoyl)amino]-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-1-yl]ethylamino]pentanoic acid;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(ethylamino)propyl]benzimidazol-2-yl]benzamide;N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-5-phenylthiophene-2-carboxamide
CID 158589711
4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-(2-phenylethyl)benzimidazol-2-yl]benzamide
CID 44588918
4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-(3-methoxypropyl)benzimidazol-2-yl]benzamide
CID 58743010
N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-3-(1,3-dioxolan-2-ylmethyl)benzamide
CID 58742879
N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-4-bromo-1H-pyrrole-2-carboxamide
CID 25155342
N-[5-[benzoyl(methyl)amino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]-4-ethenylbenzamide
CID 58742952
3-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-(3-methoxypropyl)benzimidazol-2-yl]benzamide
CID 58742504
5-bromo-N-[5-[(4-fluorobenzoyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide
CID 58742880

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide?
The IUPAC name of N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide (CID 159582071) is N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide.
What is the SMILES notation for N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide?
The canonical SMILES for N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide is CN(C(=O)C(C)(C)c1ccccc1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)C1CC(=O)NC(=O)C1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)nc1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)s1)n2CCC(N)=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)s1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(Cl)cc1)n2CCCN1CCCC1=O.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccnc(Cl)c1)n2CCC(N)=O.CN(C(=O)Cc1c[nH]c2ccccc12)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)Cc1cccc2ccccc12)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.COc1ccc(C(=O)Nc2nc3cc(N(C)C(=O)CC4CCCC4)ccc3n2CCC(N)=O)cc1OCc1ccccc1.Cc1nn(Cc2cccc(C(=O)Nc3nc4cc(N(C)C(=O)CC5CCCC5)ccc4n3CCC(N)=O)c2)c(C)c1Br.
What is the InChIKey of N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide?
The InChIKey is MJDJIWMBQBGYTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H37N5O5.C31H36BrN7O3.C31H26N6O3.C30H34N6O3.C29H34ClN5O3.C29H33N7O3.C29H25N7O3.C29H28N6O3.C28H32N6O3S.C25H23N7O5.C24H27ClN6O3.C24H26N6O3S/c1-37(31(40)18-22-8-6-7-9-22)25-13-14-27-26(20-25)35-33(38(27)17-16-30(34)39)36-32(41)24-12-15-28(42-2)29(19-24)43-21-23-10-4-3-5-11-23;1-19-29(32)20(2)39(36-19)18-22-9-6-10-23(15-22)30(42)35-31-34-25-17-24(11-12-26(25)38(31)14-13-27(33)40)37(3)28(41)16-21-7-4-5-8-21;1-36(29(39)17-23-7-4-6-21-5-2-3-8-25(21)23)24-13-14-27-26(18-24)34-31(37(27)16-15-28(33)38)35-30(40)22-11-9-20(19-32)10-12-22;1-34(28(38)18-21-6-2-3-7-21)24-13-14-26-25(19-24)32-30(33-29(39)23-11-9-22(20-31)10-12-23)36(26)17-5-16-35-15-4-8-27(35)37;1-33(27(37)18-20-6-2-3-7-20)23-13-14-25-24(19-23)31-29(32-28(38)21-9-11-22(30)12-10-21)35(25)17-5-16-34-15-4-8-26(34)36;1-34(27(38)16-20-6-2-3-7-20)23-11-12-25-24(17-23)32-29(33-28(39)21-9-10-22(18-30)31-19-21)36(25)15-5-14-35-13-4-8-26(35)37;1-35(27(38)14-20-17-32-23-5-3-2-4-22(20)23)21-10-11-25-24(15-21)33-29(36(25)13-12-26(31)37)34-28(39)19-8-6-18(16-30)7-9-19;1-29(2,21-7-5-4-6-8-21)27(38)34(3)22-13-14-24-23(17-22)32-28(35(24)16-15-25(31)36)33-26(37)20-11-9-19(18-30)10-12-20;1-32(26(36)16-19-6-2-3-7-19)20-9-11-23-22(17-20)30-28(31-27(37)24-12-10-21(18-29)38-24)34(23)15-5-14-33-13-4-8-25(33)35;1-31(24(37)16-10-21(34)29-22(35)11-16)17-6-7-19-18(12-17)28-25(32(19)9-8-20(27)33)30-23(36)15-4-2-14(13-26)3-5-15;1-30(22(33)12-15-4-2-3-5-15)17-6-7-19-18(14-17)28-24(31(19)11-9-21(26)32)29-23(34)16-8-10-27-20(25)13-16;1-29(22(32)12-15-4-2-3-5-15)16-6-8-19-18(13-16)27-24(30(19)11-10-21(26)31)28-23(33)20-9-7-17(14-25)34-20/h3-5,10-15,19-20,22H,6-9,16-18,21H2,1-2H3,(H2,34,39)(H,35,36,41);6,9-12,15,17,21H,4-5,7-8,13-14,16,18H2,1-3H3,(H2,33,40)(H,34,35,42);2-14,18H,15-17H2,1H3,(H2,33,38)(H,34,35,40);9-14,19,21H,2-8,15-18H2,1H3,(H,32,33,39);9-14,19-20H,2-8,15-18H2,1H3,(H,31,32,38);9-12,17,19-20H,2-8,13-16H2,1H3,(H,32,33,39);2-11,15,17,32H,12-14H2,1H3,(H2,31,37)(H,33,34,39);4-14,17H,15-16H2,1-3H3,(H2,31,36)(H,32,33,37);9-12,17,19H,2-8,13-16H2,1H3,(H,30,31,37);2-7,12,16H,8-11H2,1H3,(H2,27,33)(H,28,30,36)(H,29,34,35);6-8,10,13-15H,2-5,9,11-12H2,1H3,(H2,26,32)(H,28,29,34);6-9,13,15H,2-5,10-12H2,1H3,(H2,26,31)(H,27,28,33).
What are the key properties of N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide?
N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide has a molecular weight of 6363.07 g/mol, XLogP of 50.27, 105 rotatable bonds, 22 hydrogen bond donors, and 78 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-amino-3-oxopropyl)-2-[(4-cyanobenzoyl)amino]benzimidazol-5-yl]-N-methyl-2,6-dioxopiperidine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-2-chloropyridine-4-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-methoxy-3-phenylmethoxybenzamide;N-[1-(3-amino-3-oxopropyl)-5-[[2-(1H-indol-3-yl)acetyl]-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-methyl-2-phenylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2-naphthalen-1-ylacetyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]benzamide;6-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]pyridine-3-carboxamide;5-cyano-N-[5-[(2-cyclopentylacetyl)-methylamino]-1-[3-(2-oxopyrrolidin-1-yl)propyl]benzimidazol-2-yl]thiophene-2-carboxamide is sourced from PubChem (CID 159582071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).