3-{[(2-fluorophenyl)methyl]sulfanyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-1-one
Chemical Structure Depiction of
3-{[(2-fluorophenyl)methyl]sulfanyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-1-one
3-{[(2-fluorophenyl)methyl]sulfanyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | K786-6775 |
| Compound Name: | 3-{[(2-fluorophenyl)methyl]sulfanyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-1-one |
| Molecular Weight: | 426.47 |
| Molecular Formula: | C21 H22 F4 N2 O S |
| Smiles: | C(CSCc1ccccc1F)C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6266 |
| logD: | 4.6266 |
| logSw: | -4.546 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 19.6196 |
| InChI Key: | IKSIGDYEYANLOZ-UHFFFAOYSA-N |