Base information
| Cat. No. | |
| CAS No. | 173529-46-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H20N2O5S |
| Molecular Weight | 424.47 |
| Exact Mass | 424.109 |
| XLogP3 | 5.1167 |
| Mr | 116.488 |
| PSA | 97.52 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 52 |
| Ring number | 3 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1)S(=O)(=O)N(c1ccccc1/C=C/c1cc[n+](cc1)[O-])C(=O)C |
