Base information
| Cat. No. | |
| CAS No. | 14349-18-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H16BrN3O5 |
| Molecular Weight | 362.177 |
| Exact Mass | 361.027 |
| XLogP3 | 3.1127 |
| Mr | 81.2038 |
| PSA | 141.23 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 36 |
| Ring number | 1 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | NC(=O)CC[C@@H](C(=O)OCc1ccc(cc1)[N+](=O)[O-])N.Br |
