C133H156Cl6FN15O7S2 — CID 161266170
4-butyl-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentylbenzamide;3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-methoxy-N-(2-methylpropyl)benzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-4-ethylsulfanylbenzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-3-fluoro-4-methoxybenzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-4-methylsulfanylbenzamide (PubChem CID 161266170) has the molecular formula C133H156Cl6FN15O7S2 and a molecular weight of 2372.66 g/mol. Its IUPAC name is 4-butyl-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentylbenzamide;3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-methoxy-N-(2-methylpropyl)benzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-4-ethylsulfanylbenzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-3-fluoro-4-methoxybenzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-4-methylsulfanylbenzamide.
| Compound Name | 4-butyl-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentylbenzamide;3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-methoxy-N-(2-methylpropyl)benzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-4-ethylsulfanylbenzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-3-fluoro-4-methoxybenzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-4-methylsulfanylbenzamide |
|---|---|
| PubChem CID | 161266170 |
| Molecular Formula | C133H156Cl6FN15O7S2 |
| Molecular Weight | 2372.66 g/mol |
| Exact Mass | 2367.99 |
| IUPAC Name | 4-butyl-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentylbenzamide;3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-methoxy-N-(2-methylpropyl)benzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-4-ethylsulfanylbenzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-3-fluoro-4-methoxybenzamide;N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-cyclopentyl-4-methylsulfanylbenzamide |
| SMILES | CCCCc1ccc(C(=O)N(Cc2nc3ccc(Cl)cc3n2C2CCCC2)C2CCCC2)cc1.CCSc1ccc(C(=O)N(Cc2nc3ccc(Cl)cc3n2C2CCCC2)C2CCCC2)cc1.COc1ccc(C(=O)N(Cc2nc3ccc(Cl)cc3n2C2CCCC2)C2CCCC2)cc1F.COc1ccc(C(=O)N(Cc2nc3ccc(Cl)cc3n2C2CCCC2)CC(C)C)cc1Cl.CSc1ccc(C(=O)N(Cc2nc3ccc(Cl)cc3n2C2CCCC2)C2CCCC2)cc1 |
| InChI | InChI=1S/C29H36ClN3O.C27H32ClN3OS.C26H29ClFN3O2.C26H30ClN3OS.C25H29Cl2N3O2/c1-2-3-8-21-13-15-22(16-14-21)29(34)32(24-9-4-5-10-24)20-28-31-26-18-17-23(30)19-27(26)33(28)25-11-6-7-12-25;1-2-33-23-14-11-19(12-15-23)27(32)30(21-7-3-4-8-21)18-26-29-24-16-13-20(28)17-25(24)31(26)22-9-5-6-10-22;1-33-24-13-10-17(14-21(24)28)26(32)30(19-6-2-3-7-19)16-25-29-22-12-11-18(27)15-23(22)31(25)20-8-4-5-9-20;1-32-22-13-10-18(11-14-22)26(31)29(20-6-2-3-7-20)17-25-28-23-15-12-19(27)16-24(23)30(25)21-8-4-5-9-21;1-16(2)14-29(25(31)17-8-11-23(32-3)20(27)12-17)15-24-28-21-10-9-18(26)13-22(21)30(24)19-6-4-5-7-19/h13-19,24-25H,2-12,20H2,1H3;11-17,21-22H,2-10,18H2,1H3;10-15,19-20H,2-9,16H2,1H3;10-16,20-21H,2-9,17H2,1H3;8-13,16,19H,4-7,14-15H2,1-3H3 |
| InChIKey | VDFFOCKGOZNAPT-UHFFFAOYSA-N |
| XLogP | 35.65 |
| TPSA | 209.11 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 19 |
| Rotatable Bonds | 34 |
| Heavy Atoms | 164 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2372.66 |
| LogP ≤ 5 | 35.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 19 |