Base information
| Cat. No. | |
| CAS No. | 642-18-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H20N2O3 |
| Molecular Weight | 348.395 |
| Exact Mass | 348.147 |
| XLogP3 | 2.5018 |
| Mr | 99.455 |
| PSA | 52.3 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 50 |
| Ring number | 5 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)C1=CO[C@H]([C@H]2[C@@H]1Cc1[n+](C2)ccc2c1[n-]c1c2cccc1)C |
