4-cyclopropyl-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-cyclopropyl-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
4-cyclopropyl-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y500-3953 |
| Compound Name: | 4-cyclopropyl-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 303.31 |
| Molecular Formula: | C11 H12 F3 N5 S |
| Smiles: | Cc1cc(C(F)(F)F)nn1Cc1nnc(n1C1CC1)S |
| Stereo: | ACHIRAL |
| logP: | 1.3207 |
| logD: | 1.2318 |
| logSw: | -1.0619 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.799 |
| InChI Key: | TYOLREQZEHBZHL-UHFFFAOYSA-N |