N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-2-ethylbutanamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-2-ethylbutanamide--hydrogen chloride (1/1)
N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-2-ethylbutanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D388-0332 |
| Compound Name: | N-[2-(azepan-1-yl)-2-(2-chlorophenyl)ethyl]-2-ethylbutanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 387.39 |
| Molecular Formula: | C20 H31 Cl N2 O |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccccc1[Cl])N1CCCCCC1)C(C(CC)CC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8424 |
| logD: | 4.4916 |
| logSw: | -4.7686 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.2437 |
| InChI Key: | MSUUIDWSCUEUBI-IBGZPJMESA-N |