6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0256 |
| Compound Name: | 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 337.36 |
| Molecular Formula: | C16 H11 N5 O2 S |
| Smiles: | C1COc2cc(ccc2O1)c1nn2c(c3ccncc3)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 1.5033 |
| logD: | 1.5032 |
| logSw: | -1.8313 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.973 |
| InChI Key: | KHHFRRGSGJAHLT-UHFFFAOYSA-N |