5-(4-fluorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
Chemical Structure Depiction of
5-(4-fluorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
5-(4-fluorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
Compound characteristics
| Compound ID: | V005-7799 |
| Compound Name: | 5-(4-fluorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide |
| Molecular Weight: | 548.63 |
| Molecular Formula: | C31 H34 F2 N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)CC(N1CCCN(CC1)c1ccc(cc1C(NCc1ccc(cc1)F)=O)NC(c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1378 |
| logD: | 5.1355 |
| logSw: | -4.9478 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.426 |
| InChI Key: | QHBRFKUZBHKDDU-UHFFFAOYSA-N |