C194H191Cl6F4N27O11 — CID 159029094
N-[4-(6-benzoyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methylphenyl]cyclohexanecarboxamide;N-[3-chloro-4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;3,4-dichloro-N-[4-(6-chloro-1H-benzimidazol-2-yl)-2,5-dimethylphenyl]benzamide;N-[4-(6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-methoxy-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(4-methyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide (PubChem CID 159029094) has the molecular formula C194H191Cl6F4N27O11 and a molecular weight of 3365.55 g/mol. Its IUPAC name is N-[4-(6-benzoyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methylphenyl]cyclohexanecarboxamide;N-[3-chloro-4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;3,4-dichloro-N-[4-(6-chloro-1H-benzimidazol-2-yl)-2,5-dimethylphenyl]benzamide;N-[4-(6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-methoxy-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(4-methyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide.
| Compound Name | N-[4-(6-benzoyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methylphenyl]cyclohexanecarboxamide;N-[3-chloro-4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;3,4-dichloro-N-[4-(6-chloro-1H-benzimidazol-2-yl)-2,5-dimethylphenyl]benzamide;N-[4-(6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-methoxy-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(4-methyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide |
|---|---|
| PubChem CID | 159029094 |
| Molecular Formula | C194H191Cl6F4N27O11 |
| Molecular Weight | 3365.55 g/mol |
| Exact Mass | 3360.33 |
| IUPAC Name | N-[4-(6-benzoyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methylphenyl]cyclohexanecarboxamide;N-[3-chloro-4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;3,4-dichloro-N-[4-(6-chloro-1H-benzimidazol-2-yl)-2,5-dimethylphenyl]benzamide;N-[4-(6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-methoxy-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(4-methyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide |
| SMILES | COc1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1.Cc1cc(-c2nc3ccc(Cl)cc3[nH]2)c(C)cc1NC(=O)c1ccc(Cl)c(Cl)c1.Cc1cc(-c2nc3ccc(Cl)cc3[nH]2)ccc1NC(=O)C1CCCCC1.Cc1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1.Cc1cccc2[nH]c(-c3ccc(NC(=O)C4CCCCC4)cc3)nc12.O=C(Nc1ccc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)cc1)C1CCCCC1.O=C(Nc1ccc(-c2nc3ccc(Cl)cc3[nH]2)c(Cl)c1)C1CCCCC1.O=C(Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1)C1CCCCC1.O=C(c1ccccc1)c1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1 |
| InChI | InChI=1S/C27H25N3O2.C22H16Cl3N3O.C21H22ClN3O.C21H20F3N3O.C21H23N3O2.2C21H23N3O.C20H19Cl2N3O.C20H20FN3O/c31-25(18-7-3-1-4-8-18)21-13-16-23-24(17-21)30-26(29-23)19-11-14-22(15-12-19)28-27(32)20-9-5-2-6-10-20;1-11-8-19(28-22(29)13-3-5-16(24)17(25)9-13)12(2)7-15(11)21-26-18-6-4-14(23)10-20(18)27-21;1-13-11-15(20-23-18-10-8-16(22)12-19(18)24-20)7-9-17(13)25-21(26)14-5-3-2-4-6-14;22-21(23,24)15-8-11-17-18(12-15)27-19(26-17)13-6-9-16(10-7-13)25-20(28)14-4-2-1-3-5-14;1-26-17-11-12-18-19(13-17)24-20(23-18)14-7-9-16(10-8-14)22-21(25)15-5-3-2-4-6-15;1-14-6-5-9-18-19(14)24-20(23-18)15-10-12-17(13-11-15)22-21(25)16-7-3-2-4-8-16;1-14-7-12-18-19(13-14)24-20(23-18)15-8-10-17(11-9-15)22-21(25)16-5-3-2-4-6-16;21-13-6-9-17-18(10-13)25-19(24-17)15-8-7-14(11-16(15)22)23-20(26)12-4-2-1-3-5-12;21-15-8-11-17-18(12-15)24-19(23-17)13-6-9-16(10-7-13)22-20(25)14-4-2-1-3-5-14/h1,3-4,7-8,11-17,20H,2,5-6,9-10H2,(H,28,32)(H,29,30);3-10H,1-2H3,(H,26,27)(H,28,29);7-12,14H,2-6H2,1H3,(H,23,24)(H,25,26);6-12,14H,1-5H2,(H,25,28)(H,26,27);7-13,15H,2-6H2,1H3,(H,22,25)(H,23,24);5-6,9-13,16H,2-4,7-8H2,1H3,(H,22,25)(H,23,24);7-13,16H,2-6H2,1H3,(H,22,25)(H,23,24);6-12H,1-5H2,(H,23,26)(H,24,25);6-12,14H,1-5H2,(H,22,25)(H,23,24) |
| InChIKey | JUQOGJHWWUDCHM-UHFFFAOYSA-N |
| XLogP | 50.33 |
| TPSA | 546.32 Ų |
| H-Bond Donors | 18 |
| H-Bond Acceptors | 20 |
| Rotatable Bonds | 30 |
| Heavy Atoms | 242 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3365.55 |
| LogP ≤ 5 | 50.33 |
| H-Bond Donors ≤ 5 | 18 |
| H-Bond Acceptors ≤ 10 | 20 |