Base information
| Cat. No. | |
| CAS No. | 53164-05-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H18ClNO6 |
| Molecular Weight | 415.824 |
| Exact Mass | 415.082 |
| XLogP3 | 3.4705 |
| Mr | 107.02 |
| PSA | 94.83 |
| Sequence | - |
| Atom number | 47 |
| Bond number | 49 |
| Ring number | 3 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(c1)c(CC(=O)OCC(=O)O)c(n2C(=O)c1ccc(cc1)Cl)C |
