3-(2H-1,3-benzodioxol-5-yl)-6-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-6-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(2H-1,3-benzodioxol-5-yl)-6-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8020-1055 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-6-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 380.38 |
| Molecular Formula: | C18 H12 N4 O4 S |
| Smiles: | C1C(c2nn3c(c4ccc5c(c4)OCO5)nnc3s2)Oc2ccccc2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4009 |
| logD: | 3.4009 |
| logSw: | -3.73 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.274 |
| InChI Key: | RMCQNWZIKCREAX-HNNXBMFYSA-N |