Base information
| Cat. No. | |
| CAS No. | 195454-31-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C28H27NO5S |
| Molecular Weight | 489.583 |
| Exact Mass | 489.161 |
| XLogP3 | 6.0466 |
| Mr | 144.579 |
| PSA | 124.43 |
| Sequence | - |
| Atom number | 62 |
| Bond number | 66 |
| Ring number | 5 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCC[N+]1([O-])CCCCC1)c1ccc(cc1)O |
