Base information
| Cat. No. | |
| CAS No. | 774181-71-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13BrN2O2 |
| Molecular Weight | 297.148 |
| Exact Mass | 296.016 |
| XLogP3 | 2.6735 |
| Mr | 69.3781 |
| PSA | 68.11 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COC(=O)[C@H](Cc1c[nH]c2c1ccc(c2)Br)N |
