HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-[6-(2,5-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-N,N-dimethylaniline
4-[6-(2,5-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-N,N-dimethylaniline
![4-[6-(2,5-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-N,N-dimethylaniline molecular structure](/img/chemical/178741663.png)
Identifiers & Physical Properties
| CAS No. | 925145-43-3 |
|---|---|
| Molecular formula | C17H13Cl2N5S |
| Average molar mass | 390.3 g/mol |
| SMILES | CN(C)c1ccc(-c2nnc3sc(-c4cc(Cl)ccc4Cl)nn23)cc1 |
| InChIKey | UUUKEQMPIMCHJW-UHFFFAOYSA-N |
Chemical & Physical Properties
| XLogP | 5 |
|---|---|
| Topological polar surface area | 74.6 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 3 |
| Heavy atoms | 25 |
| Formal charge | 0 |
| Complexity | 462 |