3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-[(2-ethoxyphenoxy)methyl][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-ethoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-[(2-ethoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0302 |
| Compound Name: | 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-[(2-ethoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C20 H18 N4 O4 S |
| Smiles: | CCOc1ccccc1OCc1nn2c(C3COc4ccccc4O3)nnc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2557 |
| logD: | 3.2557 |
| logSw: | -3.3233 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.45 |
| InChI Key: | LEMKYBFTSAKFGR-KRWDZBQOSA-N |