Base information
| Cat. No. | |
| CAS No. | 62498-68-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H21FN2O5 |
| Molecular Weight | 400.4 |
| Exact Mass | 400.143 |
| XLogP3 | 3.01728 |
| Mr | 101.689 |
| PSA | 119.65 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 51 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C(=O)O.CNCCCC1(OCc2c1ccc(c2)C#N)c1ccc(cc1)F |
