5-(2,4-dichlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(2,4-dichlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
5-(2,4-dichlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 2219-0020 |
| Compound Name: | 5-(2,4-dichlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 286.18 |
| Molecular Formula: | C11 H9 Cl2 N3 S |
| Smiles: | C=CCn1c(c2ccc(cc2[Cl])[Cl])nnc1S |
| Stereo: | ACHIRAL |
| logP: | 3.5221 |
| logD: | 2.8916 |
| logSw: | -4.1928 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.9643 |
| InChI Key: | JMUBCVRQTQJXDS-UHFFFAOYSA-N |