HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,4-Di(benzylthiocarbamoylamino)benzene
Identifiers & Physical Properties
| Molecular formula | C22H22N4S2 |
|---|---|
| Average molar mass | 406.6 g/mol |
| SMILES | S=C(NCc1ccccc1)Nc1ccc(NC(=S)NCc2ccccc2)cc1 |
| InChIKey | QVRITLZYKIESLA-UHFFFAOYSA-N |
| PubChem CID | 19693305 |
Chemical & Physical Properties
| XLogP | 4.1 |
|---|---|
| Topological polar surface area | 112 |
| Hydrogen bond donors | 4 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 6 |
| Heavy atoms | 28 |
| Formal charge | 0 |
| Complexity | 435 |