Base information
| Cat. No. | |
| CAS No. | 153248-52-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H22BrClN2O9 |
| Molecular Weight | 537.743 |
| Exact Mass | 536.02 |
| XLogP3 | 0.503 |
| Mr | 114 |
| PSA | 181.57 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 56 |
| Ring number | 3 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]([C@H]([C@@H]1O[C@](C[C@@H]([C@H]1NC(=O)C)O)(Oc1c[nH]c2c1c(Cl)c(cc2)Br)C(=O)O)O)O |
