N-cyclohexyl-4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(3-methoxybenzamido)phenyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-cyclohexyl-4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(3-methoxybenzamido)phenyl]-1,4-diazepane-1-carboxamide
N-cyclohexyl-4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(3-methoxybenzamido)phenyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V005-2507 |
| Compound Name: | N-cyclohexyl-4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(3-methoxybenzamido)phenyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 601.72 |
| Molecular Formula: | C34 H40 F N5 O4 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(Nc1ccc(c(c1)C(NCc1ccc(cc1)F)=O)N1CCCN(CC1)C(NC1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8966 |
| logD: | 5.8898 |
| logSw: | -5.4871 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.094 |
| InChI Key: | WTPKEIVKCXBBNN-UHFFFAOYSA-N |