4-ethyl-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-ethyl-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-ethyl-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 2141-0113 |
| Compound Name: | 4-ethyl-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 219.31 |
| Molecular Formula: | C11 H13 N3 S |
| Smiles: | CCN1C(c2ccc(C)cc2)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 3.136 |
| logD: | 2.7343 |
| logSw: | -3.0422 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.5811 |
| InChI Key: | NEUNTOCSKRVRJI-UHFFFAOYSA-N |