Base information
| Cat. No. | |
| CAS No. | 80174-45-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H27NO5S |
| Molecular Weight | 393.497 |
| Exact Mass | 393.161 |
| XLogP3 | 5.126 |
| Mr | 105.509 |
| PSA | 115.07 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 54 |
| Ring number | 2 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc(cc1)S(=O)(=O)O.CC[C@H]([C@H](C(=O)OCc1ccccc1)N)C |
