4-ethyl-5-phenyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-ethyl-5-phenyl-4H-1,2,4-triazole-3-thiol
4-ethyl-5-phenyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8010-2003 |
| Compound Name: | 4-ethyl-5-phenyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 205.28 |
| Molecular Formula: | C10 H11 N3 S |
| Smiles: | CCn1c(c2ccccc2)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 2.6075 |
| logD: | 2.2059 |
| logSw: | -2.7487 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.5811 |
| InChI Key: | TWQMMYPNEWSRLM-UHFFFAOYSA-N |