4-(2-methylphenyl)-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-(2-methylphenyl)-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-(2-methylphenyl)-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | K822-0110 |
| Compound Name: | 4-(2-methylphenyl)-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 268.34 |
| Molecular Formula: | C14 H12 N4 S |
| Smiles: | Cc1ccccc1N1C(c2cccnc2)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 2.6361 |
| logD: | 1.0886 |
| logSw: | -2.5104 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.19 |
| InChI Key: | ZAGJQFIRJFZVPB-UHFFFAOYSA-N |