N-[2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-2-chlorobenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-2-chlorobenzamide--hydrogen chloride (1/1)
N-[2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-2-chlorobenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D388-1021 |
| Compound Name: | N-[2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-2-chlorobenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 407.38 |
| Molecular Formula: | C22 H27 Cl N2 O |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccc(C)cc1)N1CCCCCC1)C(c1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0717 |
| logD: | 4.5672 |
| logSw: | -5.1525 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.9721 |
| InChI Key: | BMWCPJIFBKYYCD-NRFANRHFSA-N |