6-(4-tert-butylphenyl)-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(4-tert-butylphenyl)-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(4-tert-butylphenyl)-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0219 |
| Compound Name: | 6-(4-tert-butylphenyl)-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 335.43 |
| Molecular Formula: | C18 H17 N5 S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nn2c(c3ccncc3)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.2551 |
| logD: | 4.255 |
| logSw: | -4.1018 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.15 |
| InChI Key: | ROAGHIHWUGQKBG-UHFFFAOYSA-N |