3-tert-butyl-6-[2-(4-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-tert-butyl-6-[2-(4-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-tert-butyl-6-[2-(4-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D221-0188 |
| Compound Name: | 3-tert-butyl-6-[2-(4-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 314.41 |
| Molecular Formula: | C16 H18 N4 O S |
| Smiles: | CC(C)(C)c1nnc2n1nc(/C=C/c1ccc(cc1)OC)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.6383 |
| logD: | 3.6383 |
| logSw: | -3.9517 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.032 |
| InChI Key: | UILWSRMRFOJGCJ-JXMROGBWSA-N |