N-[1-(azepan-1-yl)-2,2,2-trichloroethyl]-2-methylbenzamide
Chemical Structure Depiction of
N-[1-(azepan-1-yl)-2,2,2-trichloroethyl]-2-methylbenzamide
N-[1-(azepan-1-yl)-2,2,2-trichloroethyl]-2-methylbenzamide
Compound characteristics
| Compound ID: | 1503-0798 |
| Compound Name: | N-[1-(azepan-1-yl)-2,2,2-trichloroethyl]-2-methylbenzamide |
| Molecular Weight: | 363.71 |
| Molecular Formula: | C16 H21 Cl3 N2 O |
| Smiles: | Cc1ccccc1C(NC(C([Cl])([Cl])[Cl])N1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5809 |
| logD: | 4.347 |
| logSw: | -4.6173 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.8282 |
| InChI Key: | MTADWOLXKRNYFP-HNNXBMFYSA-N |