4-(4-amino-3,5-dichlorophenyl)-5-phenyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(4-amino-3,5-dichlorophenyl)-5-phenyl-4H-1,2,4-triazole-3-thiol
4-(4-amino-3,5-dichlorophenyl)-5-phenyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8011-6906 |
| Compound Name: | 4-(4-amino-3,5-dichlorophenyl)-5-phenyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 337.23 |
| Molecular Formula: | C14 H10 Cl2 N4 S |
| Smiles: | c1ccc(cc1)c1nnc(n1c1cc(c(c(c1)[Cl])N)[Cl])S |
| Stereo: | ACHIRAL |
| logP: | 4.0289 |
| logD: | 2.4864 |
| logSw: | -4.4804 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 42.844 |
| InChI Key: | NDEITAGKZABOMK-UHFFFAOYSA-N |