N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide

C281H284Cl7N51O29 — CID 157172648

IUPACN-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide
SMILESCC(C)C(=O)N(C)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)C1CC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)C1CCCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCc1ccc(Cl)cc1Cl.CN(C(=O)C1CCCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(Cl)cc1)n2CCc1ccc(Cl)cc1Cl.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)c1ccccc1)c1ccc2c(c1)nc(NC(=O)c1ccno1)n2CCC(N)=O.COc1ccc(CCn2c(NC(=O)c3ccc(C#N)cc3)nc3cc(N(C)C(=O)C4CCCCC4)ccc32)cc1.COc1ccc(CCn2c(NC(=O)c3ccc(Cl)cc3)nc3cc(N(C)C(=O)C4CCCCC4)ccc32)cc1.COc1ccccc1CCn1c(NC(=O)c2ccc(C#N)cc2)nc2cc(N(C)C(=O)C3CCCCC3)ccc21.COc1ccccc1CCn1c(NC(=O)c2ccc(Cl)cc2)nc2cc(N(C)C(=O)C3CCCCC3)ccc21
InChIInChI=1S/2C32H33N5O3.C31H29Cl2N5O2.2C31H33ClN4O3.C30H29Cl3N4O2.C26H28N6O3.C23H22N6O3.C23H24N6O3.C22H20N6O4/c1-36(31(39)25-9-4-3-5-10-25)26-16-17-28-27(20-26)34-32(35-30(38)24-14-12-22(21-33)13-15-24)37(28)19-18-23-8-6-7-11-29(23)40-2;1-36(31(39)25-6-4-3-5-7-25)26-14-17-29-28(20-26)34-32(35-30(38)24-12-8-23(21-33)9-13-24)37(29)19-18-22-10-15-27(40-2)16-11-22;1-37(30(40)23-5-3-2-4-6-23)25-13-14-28-27(18-25)35-31(36-29(39)22-9-7-20(19-34)8-10-22)38(28)16-15-21-11-12-24(32)17-26(21)33;1-35(30(38)23-9-4-3-5-10-23)25-16-17-27-26(20-25)33-31(34-29(37)22-12-14-24(32)15-13-22)36(27)19-18-21-8-6-7-11-28(21)39-2;1-35(30(38)23-6-4-3-5-7-23)25-14-17-28-27(20-25)33-31(34-29(37)22-10-12-24(32)13-11-22)36(28)19-18-21-8-15-26(39-2)16-9-21;1-36(29(39)21-5-3-2-4-6-21)24-13-14-27-26(18-24)34-30(35-28(38)20-8-10-22(31)11-9-20)37(27)16-15-19-7-12-23(32)17-25(19)33;1-31(24(34)14-17-4-2-3-5-17)20-10-11-22-21(15-20)29-26(32(22)13-12-23(28)33)30-25(35)19-8-6-18(16-27)7-9-19;1-28(22(32)16-6-7-16)17-8-9-19-18(12-17)26-23(29(19)11-10-20(25)30)27-21(31)15-4-2-14(13-24)3-5-15;1-14(2)22(32)28(3)17-8-9-19-18(12-17)26-23(29(19)11-10-20(25)30)27-21(31)16-6-4-15(13-24)5-7-16;1-27(21(31)14-5-3-2-4-6-14)15-7-8-17-16(13-15)25-22(28(17)12-10-19(23)29)26-20(30)18-9-11-24-32-18/h6-8,11-17,20,25H,3-5,9-10,18-19H2,1-2H3,(H,34,35,38);8-17,20,25H,3-7,18-19H2,1-2H3,(H,34,35,38);7-14,17-18,23H,2-6,15-16H2,1H3,(H,35,36,39);6-8,11-17,20,23H,3-5,9-10,18-19H2,1-2H3,(H,33,34,37);8-17,20,23H,3-7,18-19H2,1-2H3,(H,33,34,37);7-14,17-18,21H,2-6,15-16H2,1H3,(H,34,35,38);6-11,15,17H,2-5,12-14H2,1H3,(H2,28,33)(H,29,30,35);2-5,8-9,12,16H,6-7,10-11H2,1H3,(H2,25,30)(H,26,27,31);4-9,12,14H,10-11H2,1-3H3,(H2,25,30)(H,26,27,31);2-9,11,13H,10,12H2,1H3,(H2,23,29)(H,25,26,30)
InChIKeyANQOBZYQHCEFHN-UHFFFAOYSA-N
MW5087.86 g/mol
LogP51.74
Rot. Bonds75

About N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide

N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide (PubChem CID 157172648) has the molecular formula C281H284Cl7N51O29 and a molecular weight of 5087.86 g/mol. Its IUPAC name is N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide.

Molecular Properties

Compound NameN-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide
PubChem CID157172648
Molecular FormulaC281H284Cl7N51O29
Molecular Weight5087.86 g/mol
Exact Mass5081.01
IUPAC NameN-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide
SMILESCC(C)C(=O)N(C)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)C1CC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)C1CCCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCc1ccc(Cl)cc1Cl.CN(C(=O)C1CCCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(Cl)cc1)n2CCc1ccc(Cl)cc1Cl.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)c1ccccc1)c1ccc2c(c1)nc(NC(=O)c1ccno1)n2CCC(N)=O.COc1ccc(CCn2c(NC(=O)c3ccc(C#N)cc3)nc3cc(N(C)C(=O)C4CCCCC4)ccc32)cc1.COc1ccc(CCn2c(NC(=O)c3ccc(Cl)cc3)nc3cc(N(C)C(=O)C4CCCCC4)ccc32)cc1.COc1ccccc1CCn1c(NC(=O)c2ccc(C#N)cc2)nc2cc(N(C)C(=O)C3CCCCC3)ccc21.COc1ccccc1CCn1c(NC(=O)c2ccc(Cl)cc2)nc2cc(N(C)C(=O)C3CCCCC3)ccc21
InChIInChI=1S/2C32H33N5O3.C31H29Cl2N5O2.2C31H33ClN4O3.C30H29Cl3N4O2.C26H28N6O3.C23H22N6O3.C23H24N6O3.C22H20N6O4/c1-36(31(39)25-9-4-3-5-10-25)26-16-17-28-27(20-26)34-32(35-30(38)24-14-12-22(21-33)13-15-24)37(28)19-18-23-8-6-7-11-29(23)40-2;1-36(31(39)25-6-4-3-5-7-25)26-14-17-29-28(20-26)34-32(35-30(38)24-12-8-23(21-33)9-13-24)37(29)19-18-22-10-15-27(40-2)16-11-22;1-37(30(40)23-5-3-2-4-6-23)25-13-14-28-27(18-25)35-31(36-29(39)22-9-7-20(19-34)8-10-22)38(28)16-15-21-11-12-24(32)17-26(21)33;1-35(30(38)23-9-4-3-5-10-23)25-16-17-27-26(20-25)33-31(34-29(37)22-12-14-24(32)15-13-22)36(27)19-18-21-8-6-7-11-28(21)39-2;1-35(30(38)23-6-4-3-5-7-23)25-14-17-28-27(20-25)33-31(34-29(37)22-10-12-24(32)13-11-22)36(28)19-18-21-8-15-26(39-2)16-9-21;1-36(29(39)21-5-3-2-4-6-21)24-13-14-27-26(18-24)34-30(35-28(38)20-8-10-22(31)11-9-20)37(27)16-15-19-7-12-23(32)17-25(19)33;1-31(24(34)14-17-4-2-3-5-17)20-10-11-22-21(15-20)29-26(32(22)13-12-23(28)33)30-25(35)19-8-6-18(16-27)7-9-19;1-28(22(32)16-6-7-16)17-8-9-19-18(12-17)26-23(29(19)11-10-20(25)30)27-21(31)15-4-2-14(13-24)3-5-15;1-14(2)22(32)28(3)17-8-9-19-18(12-17)26-23(29(19)11-10-20(25)30)27-21(31)16-6-4-15(13-24)5-7-16;1-27(21(31)14-5-3-2-4-6-14)15-7-8-17-16(13-15)25-22(28(17)12-10-19(23)29)26-20(30)18-9-11-24-32-18/h6-8,11-17,20,25H,3-5,9-10,18-19H2,1-2H3,(H,34,35,38);8-17,20,25H,3-7,18-19H2,1-2H3,(H,34,35,38);7-14,17-18,23H,2-6,15-16H2,1H3,(H,35,36,39);6-8,11-17,20,23H,3-5,9-10,18-19H2,1-2H3,(H,33,34,37);8-17,20,23H,3-7,18-19H2,1-2H3,(H,33,34,37);7-14,17-18,21H,2-6,15-16H2,1H3,(H,34,35,38);6-11,15,17H,2-5,12-14H2,1H3,(H2,28,33)(H,29,30,35);2-5,8-9,12,16H,6-7,10-11H2,1H3,(H2,25,30)(H,26,27,31);4-9,12,14H,10-11H2,1-3H3,(H2,25,30)(H,26,27,31);2-9,11,13H,10,12H2,1H3,(H2,23,29)(H,25,26,30)
InChIKeyANQOBZYQHCEFHN-UHFFFAOYSA-N
XLogP51.74
TPSA1050.35 Ų
H-Bond Donors14
H-Bond Acceptors56
Rotatable Bonds75
Heavy Atoms368
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005087.86
LogP ≤ 551.74
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1056

Analyze N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide?
The IUPAC name of N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide (CID 157172648) is N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide.
What is the SMILES notation for N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide?
The canonical SMILES for N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide is CC(C)C(=O)N(C)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)C1CC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)C1CCCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCc1ccc(Cl)cc1Cl.CN(C(=O)C1CCCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(Cl)cc1)n2CCc1ccc(Cl)cc1Cl.CN(C(=O)CC1CCCC1)c1ccc2c(c1)nc(NC(=O)c1ccc(C#N)cc1)n2CCC(N)=O.CN(C(=O)c1ccccc1)c1ccc2c(c1)nc(NC(=O)c1ccno1)n2CCC(N)=O.COc1ccc(CCn2c(NC(=O)c3ccc(C#N)cc3)nc3cc(N(C)C(=O)C4CCCCC4)ccc32)cc1.COc1ccc(CCn2c(NC(=O)c3ccc(Cl)cc3)nc3cc(N(C)C(=O)C4CCCCC4)ccc32)cc1.COc1ccccc1CCn1c(NC(=O)c2ccc(C#N)cc2)nc2cc(N(C)C(=O)C3CCCCC3)ccc21.COc1ccccc1CCn1c(NC(=O)c2ccc(Cl)cc2)nc2cc(N(C)C(=O)C3CCCCC3)ccc21.
What is the InChIKey of N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide?
The InChIKey is ANQOBZYQHCEFHN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C32H33N5O3.C31H29Cl2N5O2.2C31H33ClN4O3.C30H29Cl3N4O2.C26H28N6O3.C23H22N6O3.C23H24N6O3.C22H20N6O4/c1-36(31(39)25-9-4-3-5-10-25)26-16-17-28-27(20-26)34-32(35-30(38)24-14-12-22(21-33)13-15-24)37(28)19-18-23-8-6-7-11-29(23)40-2;1-36(31(39)25-6-4-3-5-7-25)26-14-17-29-28(20-26)34-32(35-30(38)24-12-8-23(21-33)9-13-24)37(29)19-18-22-10-15-27(40-2)16-11-22;1-37(30(40)23-5-3-2-4-6-23)25-13-14-28-27(18-25)35-31(36-29(39)22-9-7-20(19-34)8-10-22)38(28)16-15-21-11-12-24(32)17-26(21)33;1-35(30(38)23-9-4-3-5-10-23)25-16-17-27-26(20-25)33-31(34-29(37)22-12-14-24(32)15-13-22)36(27)19-18-21-8-6-7-11-28(21)39-2;1-35(30(38)23-6-4-3-5-7-23)25-14-17-28-27(20-25)33-31(34-29(37)22-10-12-24(32)13-11-22)36(28)19-18-21-8-15-26(39-2)16-9-21;1-36(29(39)21-5-3-2-4-6-21)24-13-14-27-26(18-24)34-30(35-28(38)20-8-10-22(31)11-9-20)37(27)16-15-19-7-12-23(32)17-25(19)33;1-31(24(34)14-17-4-2-3-5-17)20-10-11-22-21(15-20)29-26(32(22)13-12-23(28)33)30-25(35)19-8-6-18(16-27)7-9-19;1-28(22(32)16-6-7-16)17-8-9-19-18(12-17)26-23(29(19)11-10-20(25)30)27-21(31)15-4-2-14(13-24)3-5-15;1-14(2)22(32)28(3)17-8-9-19-18(12-17)26-23(29(19)11-10-20(25)30)27-21(31)16-6-4-15(13-24)5-7-16;1-27(21(31)14-5-3-2-4-6-14)15-7-8-17-16(13-15)25-22(28(17)12-10-19(23)29)26-20(30)18-9-11-24-32-18/h6-8,11-17,20,25H,3-5,9-10,18-19H2,1-2H3,(H,34,35,38);8-17,20,25H,3-7,18-19H2,1-2H3,(H,34,35,38);7-14,17-18,23H,2-6,15-16H2,1H3,(H,35,36,39);6-8,11-17,20,23H,3-5,9-10,18-19H2,1-2H3,(H,33,34,37);8-17,20,23H,3-7,18-19H2,1-2H3,(H,33,34,37);7-14,17-18,21H,2-6,15-16H2,1H3,(H,34,35,38);6-11,15,17H,2-5,12-14H2,1H3,(H2,28,33)(H,29,30,35);2-5,8-9,12,16H,6-7,10-11H2,1H3,(H2,25,30)(H,26,27,31);4-9,12,14H,10-11H2,1-3H3,(H2,25,30)(H,26,27,31);2-9,11,13H,10,12H2,1H3,(H2,23,29)(H,25,26,30).
What are the key properties of N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide?
N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide has a molecular weight of 5087.86 g/mol, XLogP of 51.74, 75 rotatable bonds, 14 hydrogen bond donors, and 56 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(methyl)amino]benzimidazol-2-yl]-1,2-oxazole-5-carboxamide;N-[1-(3-amino-3-oxopropyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[cyclopropanecarbonyl(methyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;N-[1-(3-amino-3-oxopropyl)-5-[methyl(2-methylpropanoyl)amino]benzimidazol-2-yl]-4-cyanobenzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-chloro-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2,4-dichlorophenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(2-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide;4-cyano-N-[5-[cyclohexanecarbonyl(methyl)amino]-1-[2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]benzamide is sourced from PubChem (CID 157172648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).