N-[(oxolan-2-yl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
Chemical Structure Depiction of
N-[(oxolan-2-yl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
N-[(oxolan-2-yl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y509-0186 |
| Compound Name: | N-[(oxolan-2-yl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide |
| Molecular Weight: | 373.44 |
| Molecular Formula: | C17 H22 F3 N3 O S |
| Smiles: | C1CC(CNC(N2CCN(CC2)c2cccc(c2)C(F)(F)F)=S)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0668 |
| logD: | 3.0654 |
| logSw: | -3.316 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.3735 |
| InChI Key: | GCEIBLLNWJRDPK-OAHLLOKOSA-N |