3-(4-chlorophenyl)-6-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(4-chlorophenyl)-6-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(4-chlorophenyl)-6-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | IB05-5945 |
| Compound Name: | 3-(4-chlorophenyl)-6-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 358.85 |
| Molecular Formula: | C16 H15 Cl N6 S |
| Smiles: | CCn1c(C)c(c(C)n1)c1nn2c(c3ccc(cc3)[Cl])nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.05 |
| logD: | 3.05 |
| logSw: | -2.85 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 84.53 |
| InChI Key: | UMGVFBFTGOVBJB-UHFFFAOYSA-N |