Base information
| Cat. No. | |
| CAS No. | 150168-54-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H14BrF2N7O |
| Molecular Weight | 402.197 |
| Exact Mass | 401.041 |
| XLogP3 | -3.0727 |
| Mr | 84.3122 |
| PSA | 98.66 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 39 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | N[n+]1cnn(c1)CC(c1ccc(cc1F)F)(Cn1cncn1)O.[Br-] |
