6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D221-0208 |
| Compound Name: | 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 288.33 |
| Molecular Formula: | C13 H12 N4 O2 S |
| Smiles: | CCc1nnc2n1nc(c1ccc3c(c1)OCCO3)s2 |
| Stereo: | ACHIRAL |
| logP: | 1.3462 |
| logD: | 1.3462 |
| logSw: | -2.1613 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.792 |
| InChI Key: | MDVZPLCAHNFCML-UHFFFAOYSA-N |