(4H-[1]benzothiopyrano[3,4-d][1,2]oxazol-3-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(4H-[1]benzothiopyrano[3,4-d][1,2]oxazol-3-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
(4H-[1]benzothiopyrano[3,4-d][1,2]oxazol-3-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | E146-0933 |
| Compound Name: | (4H-[1]benzothiopyrano[3,4-d][1,2]oxazol-3-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone |
| Molecular Weight: | 445.46 |
| Molecular Formula: | C22 H18 F3 N3 O2 S |
| Smiles: | C1CN(CCN1C(c1c2CSc3ccccc3c2on1)=O)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.434 |
| logD: | 4.434 |
| logSw: | -4.441 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.228 |
| InChI Key: | FUOLPIHJYNAQQT-UHFFFAOYSA-N |