Base information
| Cat. No. | |
| CAS No. | 672309-91-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H13BrN2O2 |
| Molecular Weight | 285.137 |
| Exact Mass | 284.016 |
| XLogP3 | 1.9726 |
| Mr | 71.6574 |
| PSA | 50.36 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 30 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)C1CNCc2c(N1)ccc(c2)Br |
