N-(6-{4-[(2-chlorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3-methylbenzamide
Chemical Structure Depiction of
N-(6-{4-[(2-chlorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3-methylbenzamide
N-(6-{4-[(2-chlorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3-methylbenzamide
Compound characteristics
| Compound ID: | V024-1030 |
| Compound Name: | N-(6-{4-[(2-chlorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3-methylbenzamide |
| Molecular Weight: | 434.97 |
| Molecular Formula: | C25 H27 Cl N4 O |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)C(Nc1ccc(nc1)N1CCCN(CC1)Cc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4791 |
| logD: | 5.4173 |
| logSw: | -5.8805 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.255 |
| InChI Key: | YFWJKMFNYFEUHH-UHFFFAOYSA-N |