4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(4-methoxybenzamido)phenyl]-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(4-methoxybenzamido)phenyl]-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide
4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(4-methoxybenzamido)phenyl]-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V024-9491 |
| Compound Name: | 4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(4-methoxybenzamido)phenyl]-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 609.7 |
| Molecular Formula: | C35 H36 F N5 O4 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC(N1CCCN(CC1)c1ccc(cc1C(NCc1ccc(cc1)F)=O)NC(c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9137 |
| logD: | 5.9118 |
| logSw: | -5.456 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.046 |
| InChI Key: | KZUKDNDFPJZCTH-UHFFFAOYSA-N |