2-(4-fluorophenyl)-7-[({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)sulfanyl]pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Chemical Structure Depiction of
2-(4-fluorophenyl)-7-[({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)sulfanyl]pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
2-(4-fluorophenyl)-7-[({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)sulfanyl]pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Compound characteristics
| Compound ID: | F835-0190 |
| Compound Name: | 2-(4-fluorophenyl)-7-[({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)sulfanyl]pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one |
| Molecular Weight: | 488.42 |
| Molecular Formula: | C21 H12 F4 N6 O2 S |
| Smiles: | C(c1nc(c2cccc(c2)C(F)(F)F)no1)SC1=NNC(c2cc(c3ccc(cc3)F)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4663 |
| logD: | 5.4647 |
| logSw: | -6.1048 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.657 |
| InChI Key: | ZMIPUXHUZIPHDU-UHFFFAOYSA-N |