3-(4-chlorophenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(4-chlorophenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(4-chlorophenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8018-2547 |
| Compound Name: | 3-(4-chlorophenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 370.81 |
| Molecular Formula: | C17 H11 Cl N4 O2 S |
| Smiles: | C1COc2cc(ccc2O1)c1nn2c(c3ccc(cc3)[Cl])nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3471 |
| logD: | 3.3471 |
| logSw: | -3.806 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.545 |
| InChI Key: | REGKHZMWWDEBQV-UHFFFAOYSA-N |