3-(2H-1,3-benzodioxol-5-yl)-6-(5-bromopyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-6-(5-bromopyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(2H-1,3-benzodioxol-5-yl)-6-(5-bromopyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8020-1054 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-6-(5-bromopyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 402.23 |
| Molecular Formula: | C15 H8 Br N5 O2 S |
| Smiles: | C1Oc2ccc(cc2O1)c1nnc2n1nc(c1cc(cnc1)[Br])s2 |
| Stereo: | ACHIRAL |
| logP: | 3.4829 |
| logD: | 3.4828 |
| logSw: | -3.5281 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.444 |
| InChI Key: | ONDMUVLIPYBUGC-UHFFFAOYSA-N |