Base information
| Cat. No. | |
| CAS No. | 1216406-90-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H25ClN2O9 |
| Molecular Weight | 496.895 |
| Exact Mass | 496.125 |
| XLogP3 | 3.0049 |
| Mr | 120.659 |
| PSA | 175.34 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 59 |
| Ring number | 2 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C(=O)O.NCCOCc1nc(C)c(c(c1C(=O)OCC)c1ccccc1Cl)C(=O)OC |
