3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-[2-(2-methoxyphenyl)ethenyl][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-[2-(2-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-[2-(2-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0304 |
| Compound Name: | 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-[2-(2-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C20 H16 N4 O3 S |
| Smiles: | COc1ccccc1/C=C/c1nn2c(C3COc4ccccc4O3)nnc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8343 |
| logD: | 3.8343 |
| logSw: | -4.0674 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.284 |
| InChI Key: | NCUJLUKDXQWZNK-KRWDZBQOSA-N |