4-(1,3-dimethyl-1H-pyrazol-4-yl)-5-(2-methylfuran-3-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(1,3-dimethyl-1H-pyrazol-4-yl)-5-(2-methylfuran-3-yl)-4H-1,2,4-triazole-3-thiol
4-(1,3-dimethyl-1H-pyrazol-4-yl)-5-(2-methylfuran-3-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-3526 |
| Compound Name: | 4-(1,3-dimethyl-1H-pyrazol-4-yl)-5-(2-methylfuran-3-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 275.33 |
| Molecular Formula: | C12 H13 N5 O S |
| Smiles: | Cc1c(cn(C)n1)n1c(c2ccoc2C)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 0.7987 |
| logD: | -0.7182 |
| logSw: | -1.7237 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.552 |
| InChI Key: | FVBHIIRWZZQJSB-UHFFFAOYSA-N |