6-(4-bromo-3-methyl-1H-pyrazol-5-yl)-3-cyclobutyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(4-bromo-3-methyl-1H-pyrazol-5-yl)-3-cyclobutyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(4-bromo-3-methyl-1H-pyrazol-5-yl)-3-cyclobutyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8020-6636 |
| Compound Name: | 6-(4-bromo-3-methyl-1H-pyrazol-5-yl)-3-cyclobutyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 339.21 |
| Molecular Formula: | C11 H11 Br N6 S |
| Smiles: | Cc1c(c(c2nn3c(C4CCC4)nnc3s2)[nH]n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.934 |
| logD: | 1.934 |
| logSw: | -2.0165 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.353 |
| InChI Key: | PXFHTNMUEKKSFC-UHFFFAOYSA-N |