4-methyl-5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-methyl-5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
4-methyl-5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y503-2190 |
| Compound Name: | 4-methyl-5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 209.27 |
| Molecular Formula: | C8 H11 N5 S |
| Smiles: | Cc1ccn(Cc2nnc(n2C)S)n1 |
| Stereo: | ACHIRAL |
| logP: | -0.4443 |
| logD: | -0.8687 |
| logSw: | -0.4829 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.239 |
| InChI Key: | GNRJVOLROJNCTG-UHFFFAOYSA-N |