Base information
| Cat. No. | |
| CAS No. | 586333-22-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H13F3N2O |
| Molecular Weight | 318.293 |
| Exact Mass | 318.098 |
| XLogP3 | 4.5667 |
| Mr | 80.494 |
| PSA | 27.05 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 38 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1)n1nc(cc1c1ccccc1)C(F)(F)F |
