N-[4-(difluoromethoxy)phenyl]azepane-1-carbothioamide
Chemical Structure Depiction of
N-[4-(difluoromethoxy)phenyl]azepane-1-carbothioamide
N-[4-(difluoromethoxy)phenyl]azepane-1-carbothioamide
Compound characteristics
| Compound ID: | 3342-1387 |
| Compound Name: | N-[4-(difluoromethoxy)phenyl]azepane-1-carbothioamide |
| Molecular Weight: | 300.37 |
| Molecular Formula: | C14 H18 F2 N2 O S |
| Smiles: | C1CCCN(CC1)C(Nc1ccc(cc1)OC(F)F)=S |
| Stereo: | ACHIRAL |
| logP: | 3.8073 |
| logD: | 3.8073 |
| logSw: | -3.9917 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 18.0728 |
| InChI Key: | QRMRKQODZKTJLK-UHFFFAOYSA-N |