6-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8018-8445 |
| Compound Name: | 6-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 447.73 |
| Molecular Formula: | C18 H9 Cl3 N6 S |
| Smiles: | c1cc(ccc1c1cc(c2nn3c(c4ccc(cc4[Cl])[Cl])nnc3s2)n[nH]1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.7907 |
| logD: | 5.7907 |
| logSw: | -6.3974 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.211 |
| InChI Key: | DXKUEWVBBHVVOM-UHFFFAOYSA-N |