Base information
| Cat. No. | |
| CAS No. | 76-59-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C27H28Br2O5S |
| Molecular Weight | 624.381 |
| Exact Mass | 622.002 |
| XLogP3 | 8.578 |
| Mr | 146.061 |
| PSA | 92.21 |
| Sequence | - |
| Atom number | 63 |
| Bond number | 66 |
| Ring number | 4 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | Brc1c(O)c(cc(c1C)C1(OS(=O)(=O)c2c1cccc2)c1cc(C(C)C)c(c(c1C)Br)O)C(C)C |
