3-(4-tert-butylphenyl)-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(4-tert-butylphenyl)-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(4-tert-butylphenyl)-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 7009-0268 |
| Compound Name: | 3-(4-tert-butylphenyl)-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C22 H24 N4 O3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nnc2n1nc(c1cc(c(c(c1)OC)OC)OC)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.1428 |
| logD: | 5.1428 |
| logSw: | -5.1695 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.7 |
| InChI Key: | MPETZRVOYYYKNU-UHFFFAOYSA-N |