Base information
| Cat. No. | |
| CAS No. | 1409978-52-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H14F3N3O |
| Molecular Weight | 321.297 |
| Exact Mass | 321.109 |
| XLogP3 | 4.3282 |
| Mr | 84.6247 |
| PSA | 41.15 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 39 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC1=C(C=CN(C1=C)c1nc2c([nH]1)cccc2)OCC(F)(F)F |
