C190H154Cl4N28O14S2 — CID 159481984
N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-methylbenzamide;N-[4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]-4-methylbenzamide;2,4-dichloro-N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide;2,6-dichloro-N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]thiophene-2-carboxamide;N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]thiophene-3-carboxamide;4-methyl-N-[4-[6-[(2-phenylcyclopropanecarbonyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide (PubChem CID 159481984) has the molecular formula C190H154Cl4N28O14S2 and a molecular weight of 3259.45 g/mol. Its IUPAC name is N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-methylbenzamide;N-[4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]-4-methylbenzamide;2,4-dichloro-N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide;2,6-dichloro-N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]thiophene-2-carboxamide;N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]thiophene-3-carboxamide;4-methyl-N-[4-[6-[(2-phenylcyclopropanecarbonyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide.
| Compound Name | N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-methylbenzamide;N-[4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]-4-methylbenzamide;2,4-dichloro-N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide;2,6-dichloro-N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]thiophene-2-carboxamide;N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]thiophene-3-carboxamide;4-methyl-N-[4-[6-[(2-phenylcyclopropanecarbonyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide |
|---|---|
| PubChem CID | 159481984 |
| Molecular Formula | C190H154Cl4N28O14S2 |
| Molecular Weight | 3259.45 g/mol |
| Exact Mass | 3255.04 |
| IUPAC Name | N-[4-(6-acetamido-1H-benzimidazol-2-yl)phenyl]-4-methylbenzamide;N-[4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]phenyl]-4-methylbenzamide;2,4-dichloro-N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide;2,6-dichloro-N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]thiophene-2-carboxamide;N-[2-[4-[(4-methylbenzoyl)amino]phenyl]-3H-benzimidazol-5-yl]thiophene-3-carboxamide;4-methyl-N-[4-[6-[(2-phenylcyclopropanecarbonyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide |
| SMILES | CC(=O)Nc1ccc2nc(-c3ccc(NC(=O)c4ccc(C)cc4)cc3)[nH]c2c1.Cc1ccc(C(=O)Nc2ccc(-c3nc4ccc(NC(=O)C5CC5c5ccccc5)cc4[nH]3)cc2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3nc4ccc(NC(=O)C5CCCCC5)cc4[nH]3)cc2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3nc4ccc(NC(=O)c5c(Cl)cccc5Cl)cc4[nH]3)cc2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3nc4ccc(NC(=O)c5ccc(Cl)cc5Cl)cc4[nH]3)cc2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3nc4ccc(NC(=O)c5cccs5)cc4[nH]3)cc2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3nc4ccc(NC(=O)c5ccsc5)cc4[nH]3)cc2)cc1 |
| InChI | InChI=1S/C31H26N4O2.2C28H20Cl2N4O2.C28H28N4O2.2C26H20N4O2S.C23H20N4O2/c1-19-7-9-22(10-8-19)30(36)32-23-13-11-21(12-14-23)29-34-27-16-15-24(17-28(27)35-29)33-31(37)26-18-25(26)20-5-3-2-4-6-20;1-16-2-4-18(5-3-16)27(35)31-20-9-6-17(7-10-20)26-33-24-13-11-21(15-25(24)34-26)32-28(36)22-12-8-19(29)14-23(22)30;1-16-5-7-18(8-6-16)27(35)31-19-11-9-17(10-12-19)26-33-23-14-13-20(15-24(23)34-26)32-28(36)25-21(29)3-2-4-22(25)30;1-18-7-9-21(10-8-18)28(34)29-22-13-11-19(12-14-22)26-31-24-16-15-23(17-25(24)32-26)30-27(33)20-5-3-2-4-6-20;1-16-2-4-18(5-3-16)25(31)27-20-8-6-17(7-9-20)24-29-22-11-10-21(14-23(22)30-24)28-26(32)19-12-13-33-15-19;1-16-4-6-18(7-5-16)25(31)27-19-10-8-17(9-11-19)24-29-21-13-12-20(15-22(21)30-24)28-26(32)23-3-2-14-33-23;1-14-3-5-17(6-4-14)23(29)25-18-9-7-16(8-10-18)22-26-20-12-11-19(24-15(2)28)13-21(20)27-22/h2-17,25-26H,18H2,1H3,(H,32,36)(H,33,37)(H,34,35);2*2-15H,1H3,(H,31,35)(H,32,36)(H,33,34);7-17,20H,2-6H2,1H3,(H,29,34)(H,30,33)(H,31,32);2*2-15H,1H3,(H,27,31)(H,28,32)(H,29,30);3-13H,1-2H3,(H,24,28)(H,25,29)(H,26,27) |
| InChIKey | LXCPVQRFAZGCRU-UHFFFAOYSA-N |
| XLogP | 44.50 |
| TPSA | 608.16 Ų |
| H-Bond Donors | 21 |
| H-Bond Acceptors | 23 |
| Rotatable Bonds | 35 |
| Heavy Atoms | 238 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3259.45 |
| LogP ≤ 5 | 44.50 |
| H-Bond Donors ≤ 5 | 21 |
| H-Bond Acceptors ≤ 10 | 23 |