C197H206Cl5F4N29O11 — CID 157129459
N-[4-(1H-benzo[f]benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2,5-dimethylphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methoxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(cyclohexylcarbamoylamino)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide;N-[4-(5,6-dichloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide (PubChem CID 157129459) has the molecular formula C197H206Cl5F4N29O11 and a molecular weight of 3409.26 g/mol. Its IUPAC name is N-[4-(1H-benzo[f]benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2,5-dimethylphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methoxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(cyclohexylcarbamoylamino)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide;N-[4-(5,6-dichloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide.
| Compound Name | N-[4-(1H-benzo[f]benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2,5-dimethylphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methoxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(cyclohexylcarbamoylamino)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide;N-[4-(5,6-dichloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide |
|---|---|
| PubChem CID | 157129459 |
| Molecular Formula | C197H206Cl5F4N29O11 |
| Molecular Weight | 3409.26 g/mol |
| Exact Mass | 3404.48 |
| IUPAC Name | N-[4-(1H-benzo[f]benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2,5-dimethylphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methoxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(cyclohexylcarbamoylamino)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide;N-[4-(5,6-dichloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide |
| SMILES | COc1cc(-c2nc3ccc(Cl)cc3[nH]2)ccc1NC(=O)C1CCCCC1.Cc1cc(-c2nc3ccc(Cl)cc3[nH]2)c(C)cc1NC(=O)C1CCCCC1.Cc1cc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2cc1C.O=C(Nc1ccc(-c2nc3cc(Cl)c(Cl)cc3[nH]2)cc1)C1CCCCC1.O=C(Nc1ccc(-c2nc3cc4ccccc4cc3[nH]2)cc1)C1CCCCC1.O=C(Nc1ccc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)cc1)C1CCCCC1.O=C(Nc1ccc(-c2nc3ccc(Cl)cc3[nH]2)cc1)C1CCCCC1.O=C(Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1)C1CCCCC1.O=C(Nc1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1)NC1CCCCC1 |
| InChI | InChI=1S/C27H33N5O2.C24H23N3O.C22H24ClN3O.C22H25N3O.C21H22ClN3O2.C21H20F3N3O.C20H19Cl2N3O.C20H20ClN3O.C20H20FN3O/c33-26(19-7-3-1-4-8-19)28-21-13-11-18(12-14-21)25-31-23-16-15-22(17-24(23)32-25)30-27(34)29-20-9-5-2-6-10-20;28-24(17-6-2-1-3-7-17)25-20-12-10-16(11-13-20)23-26-21-14-18-8-4-5-9-19(18)15-22(21)27-23;1-13-11-19(26-22(27)15-6-4-3-5-7-15)14(2)10-17(13)21-24-18-9-8-16(23)12-20(18)25-21;1-14-12-19-20(13-15(14)2)25-21(24-19)16-8-10-18(11-9-16)23-22(26)17-6-4-3-5-7-17;1-27-19-11-14(20-23-16-10-8-15(22)12-18(16)24-20)7-9-17(19)25-21(26)13-5-3-2-4-6-13;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;21-15-10-17-18(11-16(15)22)25-19(24-17)12-6-8-14(9-7-12)23-20(26)13-4-2-1-3-5-13;2*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/h11-17,19-20H,1-10H2,(H,28,33)(H,31,32)(H2,29,30,34);4-5,8-15,17H,1-3,6-7H2,(H,25,28)(H,26,27);8-12,15H,3-7H2,1-2H3,(H,24,25)(H,26,27);8-13,17H,3-7H2,1-2H3,(H,23,26)(H,24,25);7-13H,2-6H2,1H3,(H,23,24)(H,25,26);6-12,14H,1-5H2,(H,25,28)(H,26,27);6-11,13H,1-5H2,(H,23,26)(H,24,25);2*6-12,14H,1-5H2,(H,22,25)(H,23,24) |
| InChIKey | AIWUNLHLHVDCJC-UHFFFAOYSA-N |
| XLogP | 51.01 |
| TPSA | 570.38 Ų |
| H-Bond Donors | 20 |
| H-Bond Acceptors | 20 |
| Rotatable Bonds | 30 |
| Heavy Atoms | 246 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3409.26 |
| LogP ≤ 5 | 51.01 |
| H-Bond Donors ≤ 5 | 20 |
| H-Bond Acceptors ≤ 10 | 20 |