Base information
| Cat. No. | |
| CAS No. | 1138245-21-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H25NO5S |
| Molecular Weight | 367.46 |
| Exact Mass | 367.145 |
| XLogP3 | 4.4968 |
| Mr | 95.616 |
| PSA | 126.07 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 51 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OS(=O)(=O)c1ccccc1.CCC1=C[C@@H]2[C@H](C1)C[C@]2(CN)CC(=O)O |
