6-(3,4,5-triethoxyphenyl)-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(3,4,5-triethoxyphenyl)-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(3,4,5-triethoxyphenyl)-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D221-0289 |
| Compound Name: | 6-(3,4,5-triethoxyphenyl)-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 402.39 |
| Molecular Formula: | C16 H17 F3 N4 O3 S |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)c1nn2c(C(F)(F)F)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.2869 |
| logD: | 3.2869 |
| logSw: | -3.443 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.71 |
| InChI Key: | DCDUOKPXLJIVKT-UHFFFAOYSA-N |