3-tert-butyl-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-tert-butyl-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-tert-butyl-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D221-0086 |
| Compound Name: | 3-tert-butyl-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 318.4 |
| Molecular Formula: | C15 H18 N4 O2 S |
| Smiles: | CC(C)(C)c1nnc2n1nc(c1ccc(c(c1)OC)OC)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.9707 |
| logD: | 2.9707 |
| logSw: | -3.2075 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.254 |
| InChI Key: | GDQQBRDLKXLQDZ-UHFFFAOYSA-N |