5-(3,4-dimethoxyphenyl)-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(3,4-dimethoxyphenyl)-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(3,4-dimethoxyphenyl)-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 5442-3210 |
| Compound Name: | 5-(3,4-dimethoxyphenyl)-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 265.33 |
| Molecular Formula: | C12 H15 N3 O2 S |
| Smiles: | CCN1C(c2ccc(c(c2)OC)OC)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 2.311 |
| logD: | 2.0449 |
| logSw: | -2.6893 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.842 |
| InChI Key: | VNNWZCWDOJBXTQ-UHFFFAOYSA-N |