HuagongsheHuagongshe Chemistry Print Report · For research reference only
5'-Benzylsulfamoyl-2-bromo-2',4'dichloro-acetophenone
Identifiers & Physical Properties
| Molecular formula | C15H12BrCl2NO3S |
|---|---|
| Average molar mass | 437.1 g/mol |
| Monoisotopic mass | 434.90983 g/mol |
| SMILES | O=C(CBr)c1cc(S(=O)(=O)NCc2ccccc2)c(Cl)cc1Cl |
| InChIKey | RSCBEUUQVDGGFE-UHFFFAOYSA-N |
| PubChem CID | 21394749 |
Chemical & Physical Properties
| XLogP | 4.1 |
|---|---|
| Topological polar surface area | 71.6 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 6 |
| Heavy atoms | 23 |
| Formal charge | 0 |
| Complexity | 505 |