Base information
| Cat. No. | |
| CAS No. | 1018899-04-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H25ClO5S |
| Molecular Weight | 424.938 |
| Exact Mass | 424.111 |
| XLogP3 | 3.1726 |
| Mr | 111.252 |
| PSA | 104.45 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 55 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCOc1ccc(cc1)Cc1cc(ccc1Cl)[C@@H]1O[C@H](SC)[C@H]([C@@H]([C@H]1O)O)O |