4-(3-methoxyphenyl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(3-methoxyphenyl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
4-(3-methoxyphenyl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y501-8260 |
| Compound Name: | 4-(3-methoxyphenyl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 369.37 |
| Molecular Formula: | C15 H14 F3 N5 O S |
| Smiles: | Cc1cc(C(F)(F)F)nn1Cc1nnc(n1c1cccc(c1)OC)S |
| Stereo: | ACHIRAL |
| logP: | 2.1691 |
| logD: | 0.9098 |
| logSw: | -2.338 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.178 |
| InChI Key: | WKJYVOUBCYBKJX-UHFFFAOYSA-N |