HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-Phenyl-3-phenylamino-benzo(b)thiophene
Identifiers & Physical Properties
| Molecular formula | C20H15NS |
|---|---|
| Average molar mass | 301.4 g/mol |
| Monoisotopic mass | 301.09252066 g/mol |
| SMILES | c1ccc(Nc2c(-c3ccccc3)sc3ccccc23)cc1 |
| InChIKey | TXDVOTLHFQHKLW-UHFFFAOYSA-N |
| PubChem CID | 16640361 |
Chemical & Physical Properties
| XLogP | 6.1 |
|---|---|
| Topological polar surface area | 40.3 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 3 |
| Heavy atoms | 22 |
| Formal charge | 0 |
| Complexity | 346 |