6-(4-fluorophenyl)-3-[3-(2-methylpropyl)-1H-pyrazol-5-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(4-fluorophenyl)-3-[3-(2-methylpropyl)-1H-pyrazol-5-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(4-fluorophenyl)-3-[3-(2-methylpropyl)-1H-pyrazol-5-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D727-0722 |
| Compound Name: | 6-(4-fluorophenyl)-3-[3-(2-methylpropyl)-1H-pyrazol-5-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C16 H15 F N6 S |
| Smiles: | CC(C)Cc1cc(c2nnc3n2nc(c2ccc(cc2)F)s3)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 3.8512 |
| logD: | 3.8512 |
| logSw: | -4.0453 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.978 |
| InChI Key: | ZPOHSEVKZVVWAR-UHFFFAOYSA-N |