HuagongsheHuagongshe Chemistry Print Report · For research reference only
4,4'-Di(phenylthiocarbamoylamino)benzanilide
Identifiers & Physical Properties
| Molecular formula | C27H23N5OS2 |
|---|---|
| Average molar mass | 497.6 g/mol |
| SMILES | O=C(Nc1ccc(NC(=S)Nc2ccccc2)cc1)c1ccc(NC(=S)Nc2ccccc2)cc1 |
| InChIKey | HQPBUMDSBJZECV-UHFFFAOYSA-N |
| PubChem CID | 19693281 |
Chemical & Physical Properties
| XLogP | 4.9 |
|---|---|
| Topological polar surface area | 141 |
| Hydrogen bond donors | 5 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 6 |
| Heavy atoms | 35 |
| Formal charge | 0 |
| Complexity | 692 |