N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-4-ethoxybenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-4-ethoxybenzamide--hydrogen chloride (1/1)
N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-4-ethoxybenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D388-0289 |
| Compound Name: | N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-4-ethoxybenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 437.41 |
| Molecular Formula: | C23 H29 Cl N2 O2 |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccccc1[Cl])N1CCCCCC1)C(c1ccc(cc1)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8748 |
| logD: | 4.8041 |
| logSw: | -4.8832 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.096 |
| InChI Key: | LUSMMPDXLQZRPR-QFIPXVFZSA-N |