6-[2-(4-tert-butylphenyl)ethenyl]-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[2-(4-tert-butylphenyl)ethenyl]-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[2-(4-tert-butylphenyl)ethenyl]-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | Y070-0507 |
| Compound Name: | 6-[2-(4-tert-butylphenyl)ethenyl]-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 361.47 |
| Molecular Formula: | C20 H19 N5 S |
| Smiles: | CC(C)(C)c1ccc(/C=C/c2nn3c(c4ccncc4)nnc3s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5453 |
| logD: | 4.5452 |
| logSw: | -4.2314 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.645 |
| InChI Key: | ZEEJASUSBLNMDJ-UHFFFAOYSA-N |