4-(4-[(cyclobutanecarbonyl)amino]-2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)-N-cyclohexyl-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-(4-[(cyclobutanecarbonyl)amino]-2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)-N-cyclohexyl-1,4-diazepane-1-carboxamide
4-(4-[(cyclobutanecarbonyl)amino]-2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)-N-cyclohexyl-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V024-9496 |
| Compound Name: | 4-(4-[(cyclobutanecarbonyl)amino]-2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)-N-cyclohexyl-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 549.69 |
| Molecular Formula: | C31 H40 F N5 O3 |
| Salt: | not_available |
| Smiles: | C1CCC(CC1)NC(N1CCCN(CC1)c1ccc(cc1C(NCc1ccc(cc1)F)=O)NC(C1CCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4674 |
| logD: | 4.4606 |
| logSw: | -4.2465 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.073 |
| InChI Key: | OJAKZBSLFVZXEA-UHFFFAOYSA-N |