N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-2-methylpropanamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-2-methylpropanamide--hydrogen chloride (1/1)
N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-2-methylpropanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D388-0311 |
| Compound Name: | N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-2-methylpropanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 359.34 |
| Molecular Formula: | C18 H27 Cl N2 O |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccccc1[Cl])N1CCCCCC1)C(C(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9869 |
| logD: | 3.636 |
| logSw: | -4.1415 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.2437 |
| InChI Key: | DOWBWNNUHMWDAY-KRWDZBQOSA-N |