3-(3-chloro-4-fluorophenyl)-6-[(2-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(3-chloro-4-fluorophenyl)-6-[(2-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(3-chloro-4-fluorophenyl)-6-[(2-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D727-0737 |
| Compound Name: | 3-(3-chloro-4-fluorophenyl)-6-[(2-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 390.82 |
| Molecular Formula: | C17 H12 Cl F N4 O2 S |
| Smiles: | COc1ccccc1OCc1nn2c(c3ccc(c(c3)[Cl])F)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.7294 |
| logD: | 3.7294 |
| logSw: | -4.2441 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.433 |
| InChI Key: | PQVKFOQXRGNSJM-UHFFFAOYSA-N |