3-[(4-fluorophenoxy)methyl]-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-[(4-fluorophenoxy)methyl]-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-[(4-fluorophenoxy)methyl]-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D727-0233 |
| Compound Name: | 3-[(4-fluorophenoxy)methyl]-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 416.43 |
| Molecular Formula: | C19 H17 F N4 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)c1nn2c(COc3ccc(cc3)F)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 2.7956 |
| logD: | 2.7956 |
| logSw: | -3.1604 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.175 |
| InChI Key: | UJLUKSXBRMZWCA-UHFFFAOYSA-N |