Base information
| Cat. No. | |
| CAS No. | 2102681-49-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H24F3N5O |
| Molecular Weight | 431.454 |
| Exact Mass | 431.193 |
| XLogP3 | 5.13078 |
| Mr | 112.929 |
| PSA | 90.96 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 58 |
| Ring number | 4 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | N#CC1=C(N)Oc2c(C1(C(C)C)c1cc(cc(c1)C(F)(F)F)N1CCCC1)c(C)[nH]n2 |
