N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine

C248H218F82N30O20S4 — CID 158321252

IUPACN-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine
SMILESCC(=O)Nc1ccc(-c2cnc(-c3cccc(-c4ncc(-c5ccc(NC(C)=O)cc5)[nH]4)c3)[nH]2)cc1.CC(=O)Nc1cccc(-c2c[nH]c(-c3cccc(-c4c[nH]c(-c5cccc(NC(C)=O)c5)c4)c3)c2)c1.CC(=O)Nc1ccccc1C1=CC=C(c2cccc(C3=CC=C(c4ccccc4NC(C)=O)C3)c2)C1.CC(C)(C)OC(=O)Nc1ccc(-c2ncc(-c3cccc(-c4cnc(-c5ccc(NC(=O)OC(C)(C)C)cc5)[nH]4)c3)[nH]2)cc1.CNC(=O)c1ccccc1-c1c[nH]c(-c2cccc(-c3cc(-c4ccccc4C(=O)NC)c[nH]3)c2)c1.CS(=O)(=O)c1ccc(C2=CC=C(c3cccc(C4=CC=C(c5ccc(S(C)(=O)=O)cc5)C4)c3)C2)cc1.CS(=O)(=O)c1ccccc1-c1cnc(-c2cccc(-c3ncc(-c4ccccc4S(C)(=O)=O)[nH]3)c2)[nH]1.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.c1ccc(Cc2ccc(-c3ncc(-c4cccc(-c5cnc(-c6ccc(Cc7ccccc7)cc6)[nH]5)c4)[nH]3)cc2)cc1
InChIInChI=1S/C38H30N4.C34H36N6O4.C32H28N2O2.2C30H26N4O2.C30H26O4S2.C28H24N6O2.C26H22N4O4S2.41F2/c1-3-8-27(9-4-1)22-29-14-18-31(19-15-29)37-39-25-35(41-37)33-12-7-13-34(24-33)36-26-40-38(42-36)32-20-16-30(17-21-32)23-28-10-5-2-6-11-28;1-33(2,3)43-31(41)37-25-14-10-21(11-15-25)29-35-19-27(39-29)23-8-7-9-24(18-23)28-20-36-30(40-28)22-12-16-26(17-13-22)38-32(42)44-34(4,5)6;1-21(35)33-31-12-5-3-10-29(31)27-16-14-25(19-27)23-8-7-9-24(18-23)26-15-17-28(20-26)30-11-4-6-13-32(30)34-22(2)36;1-19(35)33-27-10-4-7-22(13-27)26-16-29(31-18-26)23-8-3-6-21(12-23)25-15-30(32-17-25)24-9-5-11-28(14-24)34-20(2)36;1-31-29(35)25-12-5-3-10-23(25)21-15-27(33-17-21)19-8-7-9-20(14-19)28-16-22(18-34-28)24-11-4-6-13-26(24)30(36)32-2;1-35(31,32)29-14-10-21(11-15-29)25-6-8-27(19-25)23-4-3-5-24(18-23)28-9-7-26(20-28)22-12-16-30(17-13-22)36(2,33)34;1-17(35)31-23-10-6-19(7-11-23)25-15-29-27(33-25)21-4-3-5-22(14-21)28-30-16-26(34-28)20-8-12-24(13-9-20)32-18(2)36;1-35(31,32)23-12-5-3-10-19(23)21-15-27-25(29-21)17-8-7-9-18(14-17)26-28-16-22(30-26)20-11-4-6-13-24(20)36(2,33)34;41*1-2/h1-21,24-26H,22-23H2,(H,39,41)(H,40,42);7-20H,1-6H3,(H,35,39)(H,36,40)(H,37,41)(H,38,42);3-18H,19-20H2,1-2H3,(H,33,35)(H,34,36);3-18,31-32H,1-2H3,(H,33,35)(H,34,36);3-18,33-34H,1-2H3,(H,31,35)(H,32,36);3-18H,19-20H2,1-2H3;3-16H,1-2H3,(H,29,33)(H,30,34)(H,31,35)(H,32,36);3-16H,1-2H3,(H,27,29)(H,28,30);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyGOWLRAJXRLGQOH-UHFFFAOYSA-N
MW5624.77 g/mol
LogP88.50
Rot. Bonds50

About N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine

N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine (PubChem CID 158321252) has the molecular formula C248H218F82N30O20S4 and a molecular weight of 5624.77 g/mol. Its IUPAC name is N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine.

Molecular Properties

Compound NameN-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine
PubChem CID158321252
Molecular FormulaC248H218F82N30O20S4
Molecular Weight5624.77 g/mol
Exact Mass5621.45
IUPAC NameN-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine
SMILESCC(=O)Nc1ccc(-c2cnc(-c3cccc(-c4ncc(-c5ccc(NC(C)=O)cc5)[nH]4)c3)[nH]2)cc1.CC(=O)Nc1cccc(-c2c[nH]c(-c3cccc(-c4c[nH]c(-c5cccc(NC(C)=O)c5)c4)c3)c2)c1.CC(=O)Nc1ccccc1C1=CC=C(c2cccc(C3=CC=C(c4ccccc4NC(C)=O)C3)c2)C1.CC(C)(C)OC(=O)Nc1ccc(-c2ncc(-c3cccc(-c4cnc(-c5ccc(NC(=O)OC(C)(C)C)cc5)[nH]4)c3)[nH]2)cc1.CNC(=O)c1ccccc1-c1c[nH]c(-c2cccc(-c3cc(-c4ccccc4C(=O)NC)c[nH]3)c2)c1.CS(=O)(=O)c1ccc(C2=CC=C(c3cccc(C4=CC=C(c5ccc(S(C)(=O)=O)cc5)C4)c3)C2)cc1.CS(=O)(=O)c1ccccc1-c1cnc(-c2cccc(-c3ncc(-c4ccccc4S(C)(=O)=O)[nH]3)c2)[nH]1.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.c1ccc(Cc2ccc(-c3ncc(-c4cccc(-c5cnc(-c6ccc(Cc7ccccc7)cc6)[nH]5)c4)[nH]3)cc2)cc1
InChIInChI=1S/C38H30N4.C34H36N6O4.C32H28N2O2.2C30H26N4O2.C30H26O4S2.C28H24N6O2.C26H22N4O4S2.41F2/c1-3-8-27(9-4-1)22-29-14-18-31(19-15-29)37-39-25-35(41-37)33-12-7-13-34(24-33)36-26-40-38(42-36)32-20-16-30(17-21-32)23-28-10-5-2-6-11-28;1-33(2,3)43-31(41)37-25-14-10-21(11-15-25)29-35-19-27(39-29)23-8-7-9-24(18-23)28-20-36-30(40-28)22-12-16-26(17-13-22)38-32(42)44-34(4,5)6;1-21(35)33-31-12-5-3-10-29(31)27-16-14-25(19-27)23-8-7-9-24(18-23)26-15-17-28(20-26)30-11-4-6-13-32(30)34-22(2)36;1-19(35)33-27-10-4-7-22(13-27)26-16-29(31-18-26)23-8-3-6-21(12-23)25-15-30(32-17-25)24-9-5-11-28(14-24)34-20(2)36;1-31-29(35)25-12-5-3-10-23(25)21-15-27(33-17-21)19-8-7-9-20(14-19)28-16-22(18-34-28)24-11-4-6-13-26(24)30(36)32-2;1-35(31,32)29-14-10-21(11-15-29)25-6-8-27(19-25)23-4-3-5-24(18-23)28-9-7-26(20-28)22-12-16-30(17-13-22)36(2,33)34;1-17(35)31-23-10-6-19(7-11-23)25-15-29-27(33-25)21-4-3-5-22(14-21)28-30-16-26(34-28)20-8-12-24(13-9-20)32-18(2)36;1-35(31,32)23-12-5-3-10-19(23)21-15-27-25(29-21)17-8-7-9-18(14-17)26-28-16-22(30-26)20-11-4-6-13-24(20)36(2,33)34;41*1-2/h1-21,24-26H,22-23H2,(H,39,41)(H,40,42);7-20H,1-6H3,(H,35,39)(H,36,40)(H,37,41)(H,38,42);3-18H,19-20H2,1-2H3,(H,33,35)(H,34,36);3-18,31-32H,1-2H3,(H,33,35)(H,34,36);3-18,33-34H,1-2H3,(H,31,35)(H,32,36);3-18H,19-20H2,1-2H3;3-16H,1-2H3,(H,29,33)(H,30,34)(H,31,35)(H,32,36);3-16H,1-2H3,(H,27,29)(H,28,30);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyGOWLRAJXRLGQOH-UHFFFAOYSA-N
XLogP88.50
TPSA738.62 Ų
H-Bond Donors22
H-Bond Acceptors28
Rotatable Bonds50
Heavy Atoms384
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005624.77
LogP ≤ 588.50
H-Bond Donors ≤ 522
H-Bond Acceptors ≤ 1028

Analyze N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine with MolForge

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Related Compounds

N-[(2S)-1-[(2S)-2-[7-[5-[2-[(2S)-1-[(2S)-2-acetamido-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]thiophen-2-yl]-3H-benzo[e]benzimidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]acetamide;N-[(2S)-1-[(2S)-2-[7-[5-[2-[(2S)-1-[(2S)-2-(methanesulfonamido)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]thiophen-2-yl]-3H-benzo[e]benzimidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]methanesulfonamide;methyl N-[1-[(2S)-2-[7-[5-[2-[(2S)-1-(2-acetamido-2-deuterio-3-methylbutanoyl)pyrrolidin-2-yl]-1H-imidazol-5-yl]thiophen-2-yl]-3H-benzo[e]benzimidazol-2-yl]pyrrolidin-1-yl]-2-deuterio-3-methyl-1-oxobutan-2-yl]carbamate;methyl N-[(1S)-2-[(2S)-2-[7-[5-[2-[(2S)-1-[(2S)-2-acetamido-2-phenylacetyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]thiophen-2-yl]-3H-benzo[e]benzimidazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamate
CID 157443446
CID 158491389
CID 158491389
N-[(2S)-1-[(2S)-2-[7-[5-[2-[(2S)-1-[(2S)-2-acetamido-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]thiophen-2-yl]-3H-benzo[e]benzimidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]acetamide;methyl N-[1-[(2S)-2-[7-[5-[2-[(2S)-1-(2-acetamido-2-deuterio-3-methylbutanoyl)pyrrolidin-2-yl]-1H-imidazol-5-yl]thiophen-2-yl]-3H-benzo[e]benzimidazol-2-yl]pyrrolidin-1-yl]-2-deuterio-3-methyl-1-oxobutan-2-yl]carbamate;methyl N-[(1S)-2-[(2S)-2-[7-[5-[2-[(2S)-1-[(2S)-2-acetamido-2-phenylacetyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]thiophen-2-yl]-3H-benzo[e]benzimidazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamate;methyl N-[(2S)-1-[(2S)-2-[7-[5-[2-[(2S)-1-[(2S)-2-(methanesulfonamido)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]thiophen-2-yl]-3H-benzo[e]benzimidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]sulfamate
CID 158732750
N-[1-[2-(1H-imidazol-5-yl)ethyl]-2,3-dihydroindol-6-yl]methanesulfonamide;1-(1H-imidazol-5-ylmethyl)-2,3-dihydroindole-6-carboxamide;1-(1H-imidazol-5-ylmethyl)-2,3-dihydroindole-6-carboximidamide;1-[1-(1H-imidazol-5-ylmethyl)-2,3-dihydroindol-6-yl]-1,3-dimethylurea;N-[1-(1H-imidazol-5-ylmethyl)indol-6-yl]acetamide;1-(1H-imidazol-5-ylmethyl)-N-methyl-2,3-dihydroindole-6-sulfonamide;1-(1H-imidazol-5-ylmethyl)-6-methylsulfanyl-2,3-dihydroindole;1-(1H-imidazol-5-ylmethyl)-6-methylsulfinyl-2,3-dihydroindole
CID 158951687
1-(1H-imidazol-5-ylmethyl)-2,3-dihydroindole-6-carboxamide;1-(1H-imidazol-5-ylmethyl)-6-methylsulfanyl-2,3-dihydroindole;1-(1H-imidazol-5-ylmethyl)-6-methylsulfinyl-2,3-dihydroindole;1-(1H-imidazol-5-ylmethyl)-6-methylsulfonyl-2,3-dihydroindole;methyl N-[1-(1H-imidazol-5-ylmethyl)-2,3-dihydroindol-6-yl]carbamate;methyl N-[1-(1H-imidazol-5-ylmethyl)-2,3-dihydroindol-6-yl]-N-methylcarbamate
CID 160801424
tert-butyl N-(2-tert-butylphenyl)carbamate;1-tert-butyl-2-cyclobutylbenzene;1-tert-butyl-2-cyclohexylbenzene;2-tert-butyl-N,N-dimethylbenzamide;1-tert-butyl-2-ethylsulfonylbenzene;2-(2-tert-butylphenyl)-1H-imidazole;3-(2-tert-butylphenyl)-1-methylazetidine;2-(2-tert-butylphenyl)-1-methylimidazole;N-(3-tert-butylphenyl)-N-methylmethanesulfonamide;4-(2-tert-butylphenyl)-1-methylpiperidine;3-(2-tert-butylphenyl)-1-methylpyrrolidine;1-(2-tert-butylphenyl)propan-1-one;5-(2-tert-butylphenyl)-3H-pyrrole;1-(2-tert-butylphenyl)sulfonyl-3-methylpyrrolidine;1-[4-(2-tert-butylphenyl)sulfonylpiperazin-1-yl]ethanone;2-tert-butyl-3-propan-2-ylpyridine
CID 161196503
CID 161397984
CID 161397984

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine?
The IUPAC name of N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine (CID 158321252) is N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine.
What is the SMILES notation for N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine?
The canonical SMILES for N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine is CC(=O)Nc1ccc(-c2cnc(-c3cccc(-c4ncc(-c5ccc(NC(C)=O)cc5)[nH]4)c3)[nH]2)cc1.CC(=O)Nc1cccc(-c2c[nH]c(-c3cccc(-c4c[nH]c(-c5cccc(NC(C)=O)c5)c4)c3)c2)c1.CC(=O)Nc1ccccc1C1=CC=C(c2cccc(C3=CC=C(c4ccccc4NC(C)=O)C3)c2)C1.CC(C)(C)OC(=O)Nc1ccc(-c2ncc(-c3cccc(-c4cnc(-c5ccc(NC(=O)OC(C)(C)C)cc5)[nH]4)c3)[nH]2)cc1.CNC(=O)c1ccccc1-c1c[nH]c(-c2cccc(-c3cc(-c4ccccc4C(=O)NC)c[nH]3)c2)c1.CS(=O)(=O)c1ccc(C2=CC=C(c3cccc(C4=CC=C(c5ccc(S(C)(=O)=O)cc5)C4)c3)C2)cc1.CS(=O)(=O)c1ccccc1-c1cnc(-c2cccc(-c3ncc(-c4ccccc4S(C)(=O)=O)[nH]3)c2)[nH]1.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.FF.c1ccc(Cc2ccc(-c3ncc(-c4cccc(-c5cnc(-c6ccc(Cc7ccccc7)cc6)[nH]5)c4)[nH]3)cc2)cc1.
What is the InChIKey of N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine?
The InChIKey is GOWLRAJXRLGQOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H30N4.C34H36N6O4.C32H28N2O2.2C30H26N4O2.C30H26O4S2.C28H24N6O2.C26H22N4O4S2.41F2/c1-3-8-27(9-4-1)22-29-14-18-31(19-15-29)37-39-25-35(41-37)33-12-7-13-34(24-33)36-26-40-38(42-36)32-20-16-30(17-21-32)23-28-10-5-2-6-11-28;1-33(2,3)43-31(41)37-25-14-10-21(11-15-25)29-35-19-27(39-29)23-8-7-9-24(18-23)28-20-36-30(40-28)22-12-16-26(17-13-22)38-32(42)44-34(4,5)6;1-21(35)33-31-12-5-3-10-29(31)27-16-14-25(19-27)23-8-7-9-24(18-23)26-15-17-28(20-26)30-11-4-6-13-32(30)34-22(2)36;1-19(35)33-27-10-4-7-22(13-27)26-16-29(31-18-26)23-8-3-6-21(12-23)25-15-30(32-17-25)24-9-5-11-28(14-24)34-20(2)36;1-31-29(35)25-12-5-3-10-23(25)21-15-27(33-17-21)19-8-7-9-20(14-19)28-16-22(18-34-28)24-11-4-6-13-26(24)30(36)32-2;1-35(31,32)29-14-10-21(11-15-29)25-6-8-27(19-25)23-4-3-5-24(18-23)28-9-7-26(20-28)22-12-16-30(17-13-22)36(2,33)34;1-17(35)31-23-10-6-19(7-11-23)25-15-29-27(33-25)21-4-3-5-22(14-21)28-30-16-26(34-28)20-8-12-24(13-9-20)32-18(2)36;1-35(31,32)23-12-5-3-10-19(23)21-15-27-25(29-21)17-8-7-9-18(14-17)26-28-16-22(30-26)20-11-4-6-13-24(20)36(2,33)34;41*1-2/h1-21,24-26H,22-23H2,(H,39,41)(H,40,42);7-20H,1-6H3,(H,35,39)(H,36,40)(H,37,41)(H,38,42);3-18H,19-20H2,1-2H3,(H,33,35)(H,34,36);3-18,31-32H,1-2H3,(H,33,35)(H,34,36);3-18,33-34H,1-2H3,(H,31,35)(H,32,36);3-18H,19-20H2,1-2H3;3-16H,1-2H3,(H,29,33)(H,30,34)(H,31,35)(H,32,36);3-16H,1-2H3,(H,27,29)(H,28,30);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;.
What are the key properties of N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine?
N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine has a molecular weight of 5624.77 g/mol, XLogP of 88.50, 50 rotatable bonds, 22 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-[3-[4-(2-acetamidophenyl)cyclopenta-1,3-dien-1-yl]phenyl]cyclopenta-1,3-dien-1-yl]phenyl]acetamide;N-[4-[2-[3-[5-(4-acetamidophenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl]acetamide;N-[3-[4-[3-[4-(3-acetamidophenyl)-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]phenyl]acetamide;2-(4-benzylphenyl)-5-[3-[2-(4-benzylphenyl)-1H-imidazol-5-yl]phenyl]-1H-imidazole;1,3-bis[4-(4-methylsulfonylphenyl)cyclopenta-1,3-dien-1-yl]benzene;tert-butyl N-[4-[5-[3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]carbamate;N-methyl-2-[5-[3-[4-[2-(methylcarbamoyl)phenyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-3-yl]benzamide;5-(2-methylsulfonylphenyl)-2-[3-[5-(2-methylsulfonylphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazole;molecular fluorine is sourced from PubChem (CID 158321252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).