6-[(4-tert-butylphenoxy)methyl]-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[(4-tert-butylphenoxy)methyl]-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[(4-tert-butylphenoxy)methyl]-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D221-0147 |
| Compound Name: | 6-[(4-tert-butylphenoxy)methyl]-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 356.37 |
| Molecular Formula: | C15 H15 F3 N4 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)OCc1nn2c(C(F)(F)F)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.2185 |
| logD: | 4.2185 |
| logSw: | -4.2452 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.987 |
| InChI Key: | FLGMHVLGFMCXOJ-UHFFFAOYSA-N |