5-(2,3-dihydro-1,4-benzodioxin-2-yl)-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(2,3-dihydro-1,4-benzodioxin-2-yl)-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(2,3-dihydro-1,4-benzodioxin-2-yl)-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | D284-0238 |
| Compound Name: | 5-(2,3-dihydro-1,4-benzodioxin-2-yl)-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 263.32 |
| Molecular Formula: | C12 H13 N3 O2 S |
| Smiles: | CCN1C(C2COc3ccccc3O2)=NNC1=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6657 |
| logD: | 2.5862 |
| logSw: | -2.8524 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.018 |
| InChI Key: | PPWKEJOKXQQCFC-JTQLQIEISA-N |