6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D727-0440 |
| Compound Name: | 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 380.42 |
| Molecular Formula: | C19 H16 N4 O3 S |
| Smiles: | Cc1ccc(cc1)OCc1nnc2n1nc(c1ccc3c(c1)OCCO3)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.594 |
| logD: | 2.594 |
| logSw: | -2.8132 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.02 |
| InChI Key: | KCPHVIJLGJDBLB-UHFFFAOYSA-N |