2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide

C112H115Cl3N16O8 — CID 157440784

IUPAC2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide
SMILESCC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)NC5CCCCC5)cc4)[nH]c3c2)CC1.CC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)Nc5ccc(Cl)c(Cl)c5)cc4)[nH]c3c2)CC1.CC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)Nc5ccc(Cl)cc5)cc4)[nH]c3c2)CC1.CC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)Nc5ccccc5)cc4)[nH]c3c2)CC1
InChIInChI=1S/C28H26Cl2N4O2.C28H27ClN4O2.C28H34N4O2.C28H28N4O2/c1-16-2-9-20(10-3-16)31-28(36)19-8-13-24-25(14-19)34-26(33-24)17-4-6-18(7-5-17)27(35)32-21-11-12-22(29)23(30)15-21;1-17-2-11-22(12-3-17)31-28(35)20-8-15-24-25(16-20)33-26(32-24)18-4-6-19(7-5-18)27(34)30-23-13-9-21(29)10-14-23;2*1-18-7-14-23(15-8-18)30-28(34)21-13-16-24-25(17-21)32-26(31-24)19-9-11-20(12-10-19)27(33)29-22-5-3-2-4-6-22/h4-8,11-16,20H,2-3,9-10H2,1H3,(H,31,36)(H,32,35)(H,33,34);4-10,13-17,22H,2-3,11-12H2,1H3,(H,30,34)(H,31,35)(H,32,33);9-13,16-18,22-23H,2-8,14-15H2,1H3,(H,29,33)(H,30,34)(H,31,32);2-6,9-13,16-18,23H,7-8,14-15H2,1H3,(H,29,33)(H,30,34)(H,31,32)
InChIKeyBRQLHGRKAGHITN-UHFFFAOYSA-N
MW1919.61 g/mol
LogP24.93
Rot. Bonds20

About 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide

2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide (PubChem CID 157440784) has the molecular formula C112H115Cl3N16O8 and a molecular weight of 1919.61 g/mol. Its IUPAC name is 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound Name2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide
PubChem CID157440784
Molecular FormulaC112H115Cl3N16O8
Molecular Weight1919.61 g/mol
Exact Mass1916.81
IUPAC Name2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide
SMILESCC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)NC5CCCCC5)cc4)[nH]c3c2)CC1.CC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)Nc5ccc(Cl)c(Cl)c5)cc4)[nH]c3c2)CC1.CC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)Nc5ccc(Cl)cc5)cc4)[nH]c3c2)CC1.CC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)Nc5ccccc5)cc4)[nH]c3c2)CC1
InChIInChI=1S/C28H26Cl2N4O2.C28H27ClN4O2.C28H34N4O2.C28H28N4O2/c1-16-2-9-20(10-3-16)31-28(36)19-8-13-24-25(14-19)34-26(33-24)17-4-6-18(7-5-17)27(35)32-21-11-12-22(29)23(30)15-21;1-17-2-11-22(12-3-17)31-28(35)20-8-15-24-25(16-20)33-26(32-24)18-4-6-19(7-5-18)27(34)30-23-13-9-21(29)10-14-23;2*1-18-7-14-23(15-8-18)30-28(34)21-13-16-24-25(17-21)32-26(31-24)19-9-11-20(12-10-19)27(33)29-22-5-3-2-4-6-22/h4-8,11-16,20H,2-3,9-10H2,1H3,(H,31,36)(H,32,35)(H,33,34);4-10,13-17,22H,2-3,11-12H2,1H3,(H,30,34)(H,31,35)(H,32,33);9-13,16-18,22-23H,2-8,14-15H2,1H3,(H,29,33)(H,30,34)(H,31,32);2-6,9-13,16-18,23H,7-8,14-15H2,1H3,(H,29,33)(H,30,34)(H,31,32)
InChIKeyBRQLHGRKAGHITN-UHFFFAOYSA-N
XLogP24.93
TPSA347.52 Ų
H-Bond Donors12
H-Bond Acceptors12
Rotatable Bonds20
Heavy Atoms139
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001919.61
LogP ≤ 524.93
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1012

Analyze 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide with MolForge

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Related Compounds

N,N'-bis[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methyl]tridecanediamide
CID 145970174
2-[4-[(4-chlorophenyl)-methylcarbamoyl]phenyl]-3H-benzimidazole-5-carboxamide
CID 58961522
N,N'-bis[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methyl]undecanediamide
CID 145968592
N,N'-bis[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methyl]heptanediamide
CID 145968838
N,N'-bis[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methyl]propanediamide
CID 145969953
N,N'-bis[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methyl]nonanediamide
CID 145970833
N,N'-bis[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methyl]pentanediamide
CID 145971083
N-[3-(dimethylamino)propyl]-2-[2-[[[2-[4-[2-[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methylamino]-2-oxoethyl]piperazin-1-yl]acetyl]amino]methyl]-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxamide
CID 156015028
N-[3-(dimethylamino)propyl]-2-[2-[[3-[4-[3-[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methylamino]-3-oxopropyl]piperazin-1-yl]propanoylamino]methyl]-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxamide
CID 156020974
N-[3-(dimethylamino)propyl]-2-[2-[[4-[4-[4-[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methylamino]-4-oxobutyl]piperazin-1-yl]butanoylamino]methyl]-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxamide
CID 156021008
N-[3-(dimethylamino)propyl]-2-[2-[[5-[4-[5-[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methylamino]-5-oxopentyl]piperazin-1-yl]pentanoylamino]methyl]-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxamide
CID 156022106
2-[4-(3,4-Dichloro-phenylcarbamoyl)-phenyl]-1H-benzoimidazole-5-carboxylic acid amide
CID 11441679

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide?
The IUPAC name of 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide (CID 157440784) is 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide?
The canonical SMILES for 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide is CC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)NC5CCCCC5)cc4)[nH]c3c2)CC1.CC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)Nc5ccc(Cl)c(Cl)c5)cc4)[nH]c3c2)CC1.CC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)Nc5ccc(Cl)cc5)cc4)[nH]c3c2)CC1.CC1CCC(NC(=O)c2ccc3nc(-c4ccc(C(=O)Nc5ccccc5)cc4)[nH]c3c2)CC1.
What is the InChIKey of 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide?
The InChIKey is BRQLHGRKAGHITN-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26Cl2N4O2.C28H27ClN4O2.C28H34N4O2.C28H28N4O2/c1-16-2-9-20(10-3-16)31-28(36)19-8-13-24-25(14-19)34-26(33-24)17-4-6-18(7-5-17)27(35)32-21-11-12-22(29)23(30)15-21;1-17-2-11-22(12-3-17)31-28(35)20-8-15-24-25(16-20)33-26(32-24)18-4-6-19(7-5-18)27(34)30-23-13-9-21(29)10-14-23;2*1-18-7-14-23(15-8-18)30-28(34)21-13-16-24-25(17-21)32-26(31-24)19-9-11-20(12-10-19)27(33)29-22-5-3-2-4-6-22/h4-8,11-16,20H,2-3,9-10H2,1H3,(H,31,36)(H,32,35)(H,33,34);4-10,13-17,22H,2-3,11-12H2,1H3,(H,30,34)(H,31,35)(H,32,33);9-13,16-18,22-23H,2-8,14-15H2,1H3,(H,29,33)(H,30,34)(H,31,32);2-6,9-13,16-18,23H,7-8,14-15H2,1H3,(H,29,33)(H,30,34)(H,31,32).
What are the key properties of 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide?
2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide has a molecular weight of 1919.61 g/mol, XLogP of 24.93, 20 rotatable bonds, 12 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexylcarbamoyl)phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;2-[4-[(3,4-dichlorophenyl)carbamoyl]phenyl]-N-(4-methylcyclohexyl)-3H-benzimidazole-5-carboxamide;N-(4-methylcyclohexyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 157440784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).