3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0308 |
| Compound Name: | 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C15 H10 N4 O2 S2 |
| Smiles: | C1C(c2nnc3n2nc(c2cccs2)s3)Oc2ccccc2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2784 |
| logD: | 3.2784 |
| logSw: | -3.3322 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.177 |
| InChI Key: | VAAPDGVOQIGZBE-NSHDSACASA-N |