HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-benzenesulfonyl-3-(3,4-dimethoxy-phenyl)-1H-indole
Identifiers & Physical Properties
| Molecular formula | C22H19NO4S |
|---|---|
| Average molar mass | 393.5 g/mol |
| SMILES | COc1ccc(-c2cn(S(=O)(=O)c3ccccc3)c3ccccc23)cc1OC |
| InChIKey | HVSFCAFTPVZUFK-UHFFFAOYSA-N |
| PubChem CID | 57891749 |
Chemical & Physical Properties
| XLogP | 4.8 |
|---|---|
| Topological polar surface area | 65.9 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 5 |
| Heavy atoms | 28 |
| Formal charge | 0 |
| Complexity | 613 |