5-(4-chlorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]benzamide
Chemical Structure Depiction of
5-(4-chlorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]benzamide
5-(4-chlorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]benzamide
Compound characteristics
| Compound ID: | V024-9696 |
| Compound Name: | 5-(4-chlorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]benzamide |
| Molecular Weight: | 627.16 |
| Molecular Formula: | C36 H36 Cl F N4 O3 |
| Salt: | not_available |
| Smiles: | CCC(C(N1CCCN(CC1)c1ccc(cc1C(NCc1ccc(cc1)F)=O)NC(c1ccc(cc1)[Cl])=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9203 |
| logD: | 6.918 |
| logSw: | -6.2399 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.682 |
| InChI Key: | MYLRIFXOOUJKGE-WJOKGBTCSA-N |