4-(2-methylpropyl)-5-[2-(4-methyl-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(2-methylpropyl)-5-[2-(4-methyl-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
4-(2-methylpropyl)-5-[2-(4-methyl-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y500-8823 |
| Compound Name: | 4-(2-methylpropyl)-5-[2-(4-methyl-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 265.38 |
| Molecular Formula: | C12 H19 N5 S |
| Smiles: | CC(C)Cn1c(CCn2cc(C)cn2)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.6604 |
| logD: | 1.4513 |
| logSw: | -0.984 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.718 |
| InChI Key: | WKIBOUPAXJHSEH-UHFFFAOYSA-N |