4-(2-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(2-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazole-3-thiol
4-(2-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8015-7812 |
| Compound Name: | 4-(2-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 269.33 |
| Molecular Formula: | C13 H11 N5 S |
| Smiles: | Cc1ccccc1n1c(c2cnccn2)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.6665 |
| logD: | -0.408 |
| logSw: | -0.6138 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.722 |
| InChI Key: | JLKQUTJUERPANB-UHFFFAOYSA-N |