4-(2-methoxyphenyl)-5-(1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(2-methoxyphenyl)-5-(1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
4-(2-methoxyphenyl)-5-(1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8015-6581 |
| Compound Name: | 4-(2-methoxyphenyl)-5-(1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 273.31 |
| Molecular Formula: | C12 H11 N5 O S |
| Smiles: | COc1ccccc1n1c(c2ccn[nH]2)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.4406 |
| logD: | 0.5498 |
| logSw: | -1.7327 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.389 |
| InChI Key: | LMSXWPNPVVEPCJ-UHFFFAOYSA-N |