4-(2-methylpropyl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(2-methylpropyl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
4-(2-methylpropyl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y501-8257 |
| Compound Name: | 4-(2-methylpropyl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 319.35 |
| Molecular Formula: | C12 H16 F3 N5 S |
| Smiles: | CC(C)Cn1c(Cn2c(C)cc(C(F)(F)F)n2)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 2.0832 |
| logD: | 1.8755 |
| logSw: | -1.7775 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.163 |
| InChI Key: | NRAMVPKRHQRASC-UHFFFAOYSA-N |