5-(2,4-dichlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(2,4-dichlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(2,4-dichlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8006-5216 |
| Compound Name: | 5-(2,4-dichlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 246.11 |
| Molecular Formula: | C8 H5 Cl2 N3 S |
| Smiles: | c1cc(C2NC(NN=2)=S)c(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9448 |
| logD: | -2.6149 |
| logSw: | -4.0193 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.399 |
| InChI Key: | BZLULSOSPSQTAL-UHFFFAOYSA-N |