3-tert-butyl-6-[(3,4-dimethoxyphenyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-tert-butyl-6-[(3,4-dimethoxyphenyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-tert-butyl-6-[(3,4-dimethoxyphenyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D221-0294 |
| Compound Name: | 3-tert-butyl-6-[(3,4-dimethoxyphenyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 332.42 |
| Molecular Formula: | C16 H20 N4 O2 S |
| Smiles: | CC(C)(C)c1nnc2n1nc(Cc1ccc(c(c1)OC)OC)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.9076 |
| logD: | 2.9076 |
| logSw: | -3.1228 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.749 |
| InChI Key: | HLASKEODHFUKQW-UHFFFAOYSA-N |