3-(3,4-dimethoxyphenyl)-6-[(3,4-dimethylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-6-[(3,4-dimethylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(3,4-dimethoxyphenyl)-6-[(3,4-dimethylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D727-0019 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-6-[(3,4-dimethylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 396.47 |
| Molecular Formula: | C20 H20 N4 O3 S |
| Smiles: | Cc1ccc(cc1C)OCc1nn2c(c3ccc(c(c3)OC)OC)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.103 |
| logD: | 4.103 |
| logSw: | -4.3594 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.977 |
| InChI Key: | SSVBRFNLYJQYMX-UHFFFAOYSA-N |