3-(pyridin-4-yl)-6-{2-[2-(trifluoromethyl)phenyl]ethenyl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(pyridin-4-yl)-6-{2-[2-(trifluoromethyl)phenyl]ethenyl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(pyridin-4-yl)-6-{2-[2-(trifluoromethyl)phenyl]ethenyl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D731-0781 |
| Compound Name: | 3-(pyridin-4-yl)-6-{2-[2-(trifluoromethyl)phenyl]ethenyl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 373.36 |
| Molecular Formula: | C17 H10 F3 N5 S |
| Smiles: | C(=C/c1nn2c(c3ccncc3)nnc2s1)\c1ccccc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.5758 |
| logD: | 3.5757 |
| logSw: | -3.8132 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.645 |
| InChI Key: | UTAYECCAUFYYAS-UHFFFAOYSA-N |