Base information
| Cat. No. | |
| CAS No. | 37889-60-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H20BrN3O |
| Molecular Weight | 398.296 |
| Exact Mass | 397.079 |
| XLogP3 | 1.751 |
| Mr | 111.265 |
| PSA | 65.15 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 46 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Nc1ccc2c(c1)c(c1ccccc1)[n+](c1c2ccc(c1)N)C.[Br-].O |
