3-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(propan-2-yl)-1H-pyrazol-5-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(propan-2-yl)-1H-pyrazol-5-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(propan-2-yl)-1H-pyrazol-5-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8020-6422 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(propan-2-yl)-1H-pyrazol-5-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 372.88 |
| Molecular Formula: | C17 H17 Cl N6 S |
| Smiles: | CC(C)c1cc(c2nn3c(Cc4ccccc4[Cl])nnc3s2)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6342 |
| logD: | 3.6342 |
| logSw: | -3.7663 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 48.214 |
| InChI Key: | WXQFVWREBQXYPB-UHFFFAOYSA-N |