6-[2-(2-chlorophenyl)ethenyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[2-(2-chlorophenyl)ethenyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[2-(2-chlorophenyl)ethenyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D181-0119 |
| Compound Name: | 6-[2-(2-chlorophenyl)ethenyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 339.8 |
| Molecular Formula: | C16 H10 Cl N5 S |
| Smiles: | C(=C/c1nn2c(c3cccnc3)nnc2s1)\c1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.0499 |
| logD: | 3.0496 |
| logSw: | -3.6311 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.735 |
| InChI Key: | KXGCGIOSHLQCSZ-UHFFFAOYSA-N |