N-cyclohexyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-[(4-methylbenzene-1-sulfonyl)amino]phenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-cyclohexyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-[(4-methylbenzene-1-sulfonyl)amino]phenyl)-1,4-diazepane-1-carboxamide
N-cyclohexyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-[(4-methylbenzene-1-sulfonyl)amino]phenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V024-9509 |
| Compound Name: | N-cyclohexyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-[(4-methylbenzene-1-sulfonyl)amino]phenyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 621.78 |
| Molecular Formula: | C33 H40 F N5 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)S(Nc1ccc(c(c1)C(NCc1ccc(cc1)F)=O)N1CCCN(CC1)C(NC1CCCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1699 |
| logD: | 6.0671 |
| logSw: | -5.4304 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.108 |
| InChI Key: | SJBIDJZNEZABFB-UHFFFAOYSA-N |