6-(4-nitrophenyl)-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(4-nitrophenyl)-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(4-nitrophenyl)-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D181-0196 |
| Compound Name: | 6-(4-nitrophenyl)-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 324.32 |
| Molecular Formula: | C14 H8 N6 O2 S |
| Smiles: | c1cc(cnc1)c1nnc2n1nc(c1ccc(cc1)[N+]([O-])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.1548 |
| logD: | 2.1544 |
| logSw: | -1.9628 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.621 |
| InChI Key: | SIDCTRHLUZDUSF-UHFFFAOYSA-N |