6-[(4-tert-butylphenoxy)methyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[(4-tert-butylphenoxy)methyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[(4-tert-butylphenoxy)methyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D727-0076 |
| Compound Name: | 6-[(4-tert-butylphenoxy)methyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 365.46 |
| Molecular Formula: | C19 H19 N5 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)OCc1nn2c(c3cccnc3)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.7581 |
| logD: | 3.7577 |
| logSw: | -3.669 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.234 |
| InChI Key: | URGUOPSROBEPRI-UHFFFAOYSA-N |