C285H297Cl6FN40O20 — CID 159207880
N-[4-(1H-benzo[f]benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-benzoyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-hydroxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-3-methoxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methylphenyl]cyclohexanecarboxamide;N-[3-chloro-4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(4,5-dimethyl-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;methyl 2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazole-5-carboxylate;N-[4-[6-(pentanoylamino)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide (PubChem CID 159207880) has the molecular formula C285H297Cl6FN40O20 and a molecular weight of 4834.49 g/mol. Its IUPAC name is N-[4-(1H-benzo[f]benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-benzoyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-hydroxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-3-methoxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methylphenyl]cyclohexanecarboxamide;N-[3-chloro-4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(4,5-dimethyl-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;methyl 2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazole-5-carboxylate;N-[4-[6-(pentanoylamino)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide.
| Compound Name | N-[4-(1H-benzo[f]benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-benzoyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-hydroxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-3-methoxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methylphenyl]cyclohexanecarboxamide;N-[3-chloro-4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(4,5-dimethyl-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;methyl 2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazole-5-carboxylate;N-[4-[6-(pentanoylamino)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide |
|---|---|
| PubChem CID | 159207880 |
| Molecular Formula | C285H297Cl6FN40O20 |
| Molecular Weight | 4834.49 g/mol |
| Exact Mass | 4828.16 |
| IUPAC Name | N-[4-(1H-benzo[f]benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-benzoyl-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-hydroxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-3-methoxyphenyl]cyclohexanecarboxamide;N-[4-(6-chloro-1H-benzimidazol-2-yl)-2-methylphenyl]cyclohexanecarboxamide;N-[3-chloro-4-(6-chloro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)phenyl]cyclohexanecarboxamide;N-[4-(4,5-dimethyl-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;methyl 2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazole-5-carboxylate;N-[4-[6-(pentanoylamino)-1H-benzimidazol-2-yl]phenyl]cyclohexanecarboxamide |
| SMILES | CCCCC(=O)Nc1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1.COC(=O)c1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1.COc1cc(NC(=O)C2CCCCC2)ccc1-c1nc2ccc(Cl)cc2[nH]1.COc1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1.Cc1cc(-c2nc3ccc(Cl)cc3[nH]2)ccc1NC(=O)C1CCCCC1.Cc1ccc2[nH]c(-c3ccc(NC(=O)C4CCCCC4)cc3)nc2c1C.Cc1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1.Cc1cccc2[nH]c(-c3ccc(NC(=O)C4CCCCC4)cc3)nc12.O=C(Nc1ccc(-c2nc3cc(Cl)c(F)cc3[nH]2)cc1)C1CCCCC1.O=C(Nc1ccc(-c2nc3cc4ccccc4cc3[nH]2)cc1)C1CCCCC1.O=C(Nc1ccc(-c2nc3ccc(Cl)cc3[nH]2)c(Cl)c1)C1CCCCC1.O=C(Nc1ccc(-c2nc3ccc(Cl)cc3[nH]2)cc1O)C1CCCCC1.O=C(c1ccccc1)c1ccc2nc(-c3ccc(NC(=O)C4CCCCC4)cc3)[nH]c2c1 |
| InChI | InChI=1S/C27H25N3O2.C25H30N4O2.C24H23N3O.C22H23N3O3.C22H25N3O.C21H22ClN3O2.C21H22ClN3O.C21H23N3O2.2C21H23N3O.C20H19Cl2N3O.C20H19ClFN3O.C20H20ClN3O2/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;1-2-3-9-23(30)26-20-14-15-21-22(16-20)29-24(28-21)17-10-12-19(13-11-17)27-25(31)18-7-5-4-6-8-18;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;1-28-22(27)16-9-12-18-19(13-16)25-20(24-18)14-7-10-17(11-8-14)23-21(26)15-5-3-2-4-6-15;1-14-8-13-19-20(15(14)2)25-21(24-19)16-9-11-18(12-10-16)23-22(26)17-6-4-3-5-7-17;1-27-19-12-15(23-21(26)13-5-3-2-4-6-13)8-9-16(19)20-24-17-10-7-14(22)11-18(17)25-20;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;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;21-15-10-17-18(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;21-14-7-9-15-17(11-14)23-19(22-15)13-6-8-16(18(25)10-13)24-20(26)12-4-2-1-3-5-12/h1,3-4,7-8,11-17,20H,2,5-6,9-10H2,(H,28,32)(H,29,30);10-16,18H,2-9H2,1H3,(H,26,30)(H,27,31)(H,28,29);4-5,8-15,17H,1-3,6-7H2,(H,25,28)(H,26,27);7-13,15H,2-6H2,1H3,(H,23,26)(H,24,25);8-13,17H,3-7H2,1-2H3,(H,23,26)(H,24,25);7-13H,2-6H2,1H3,(H,23,26)(H,24,25);7-12,14H,2-6H2,1H3,(H,23,24)(H,25,26);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);6-11,13H,1-5H2,(H,23,26)(H,24,25);6-12,25H,1-5H2,(H,22,23)(H,24,26) |
| InChIKey | KQCOEYHEPNQTQB-UHFFFAOYSA-N |
| XLogP | 70.36 |
| TPSA | 862.30 Ų |
| H-Bond Donors | 28 |
| H-Bond Acceptors | 33 |
| Rotatable Bonds | 48 |
| Heavy Atoms | 352 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4834.49 |
| LogP ≤ 5 | 70.36 |
| H-Bond Donors ≤ 5 | 28 |
| H-Bond Acceptors ≤ 10 | 33 |