6-(4-bromo-1H-pyrazol-3-yl)-3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(4-bromo-1H-pyrazol-3-yl)-3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(4-bromo-1H-pyrazol-3-yl)-3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8020-2185 |
| Compound Name: | 6-(4-bromo-1H-pyrazol-3-yl)-3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 377.22 |
| Molecular Formula: | C13 H9 Br N6 O S |
| Smiles: | COc1ccc(cc1)c1nnc2n1nc(c1c(c[nH]n1)[Br])s2 |
| Stereo: | ACHIRAL |
| logP: | 2.8243 |
| logD: | 2.8243 |
| logSw: | -3.364 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.727 |
| InChI Key: | AFJFXHIIQXBJLS-UHFFFAOYSA-N |