Base information
| Cat. No. | |
| CAS No. | 6625-20-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H23ClN2O7 |
| Molecular Weight | 450.87 |
| Exact Mass | 450.119 |
| XLogP3 | 1.6229 |
| Mr | 111.331 |
| PSA | 161.39 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CN([C@H]1C(=C(C(=O)N)C(=O)[C@]2([C@@H]1C[C@H]1Cc3cccc(c3C(=O)C1=C2O)O)O)O)C.Cl |
