5-(4-chlorobenzamido)-2-[4-(2-fluorobenzoyl)-1,4-diazepan-1-yl]-N-[(4-fluorophenyl)methyl]benzamide
Chemical Structure Depiction of
5-(4-chlorobenzamido)-2-[4-(2-fluorobenzoyl)-1,4-diazepan-1-yl]-N-[(4-fluorophenyl)methyl]benzamide
5-(4-chlorobenzamido)-2-[4-(2-fluorobenzoyl)-1,4-diazepan-1-yl]-N-[(4-fluorophenyl)methyl]benzamide
Compound characteristics
| Compound ID: | V025-4653 |
| Compound Name: | 5-(4-chlorobenzamido)-2-[4-(2-fluorobenzoyl)-1,4-diazepan-1-yl]-N-[(4-fluorophenyl)methyl]benzamide |
| Molecular Weight: | 603.07 |
| Molecular Formula: | C33 H29 Cl F2 N4 O3 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1ccc(cc1C(NCc1ccc(cc1)F)=O)NC(c1ccc(cc1)[Cl])=O)C(c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8779 |
| logD: | 5.8758 |
| logSw: | -6.0643 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.682 |
| InChI Key: | NHTPAQJSCXSJFV-UHFFFAOYSA-N |