5-(2,4-dichlorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(2,4-dichlorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazole-3-thiol
5-(2,4-dichlorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 2219-0070 |
| Compound Name: | 5-(2,4-dichlorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 336.24 |
| Molecular Formula: | C15 H11 Cl2 N3 S |
| Smiles: | Cc1ccccc1n1c(c2ccc(cc2[Cl])[Cl])nnc1S |
| Stereo: | ACHIRAL |
| logP: | 4.6275 |
| logD: | 2.1264 |
| logSw: | -5.0567 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.1568 |
| InChI Key: | KQIRTXDTOXJSCL-UHFFFAOYSA-N |