6-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-3-(propan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-3-(propan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-3-(propan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8019-9791 |
| Compound Name: | 6-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-3-(propan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 340.4 |
| Molecular Formula: | C16 H16 N6 O S |
| Smiles: | CC(C)c1nnc2n1nc(c1cc(c3ccc(cc3)OC)[nH]n1)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.3866 |
| logD: | 3.3866 |
| logSw: | -3.755 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.027 |
| InChI Key: | XVAMHCKZAQHFPK-UHFFFAOYSA-N |