N-benzyl-5-(2-chlorobenzamido)-2-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]-N-methylbenzamide
Chemical Structure Depiction of
N-benzyl-5-(2-chlorobenzamido)-2-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]-N-methylbenzamide
N-benzyl-5-(2-chlorobenzamido)-2-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]-N-methylbenzamide
Compound characteristics
| Compound ID: | V024-6825 |
| Compound Name: | N-benzyl-5-(2-chlorobenzamido)-2-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]-N-methylbenzamide |
| Molecular Weight: | 599.11 |
| Molecular Formula: | C34 H32 Cl F N4 O3 |
| Salt: | not_available |
| Smiles: | CN(Cc1ccccc1)C(c1cc(ccc1N1CCCN(CC1)C(c1cccc(c1)F)=O)NC(c1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7449 |
| logD: | 5.7445 |
| logSw: | -5.7239 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.419 |
| InChI Key: | CAWGKCARULYMRQ-UHFFFAOYSA-N |