Base information
| Cat. No. | |
| CAS No. | 178420-75-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H16F3N5O4 |
| Molecular Weight | 399.325 |
| Exact Mass | 399.115 |
| XLogP3 | 0.6563 |
| Mr | 89.2657 |
| PSA | 135.52 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 46 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H](C[C@@H]1O)n1cc(c2c1ncnc2N)C#CCNC(=O)C(F)(F)F |
