Base information
| Cat. No. | |
| CAS No. | 5189-11-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C23H25NO4S |
| Molecular Weight | 411.514 |
| Exact Mass | 411.15 |
| XLogP3 | 4.0239 |
| Mr | 119.859 |
| PSA | 106.08 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1.OC(=O)/C=C\C(=O)O |
