3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-[(4-methoxyphenoxy)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-[(4-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-[(4-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0300 |
| Compound Name: | 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-[(4-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 396.42 |
| Molecular Formula: | C19 H16 N4 O4 S |
| Smiles: | COc1ccc(cc1)OCc1nn2c(C3COc4ccccc4O3)nnc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1454 |
| logD: | 3.1454 |
| logSw: | -3.2406 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.697 |
| InChI Key: | TUYBJRLPGVEKPP-INIZCTEOSA-N |