Base information
| Cat. No. | |
| CAS No. | 1216-40-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H17BrN2O3 |
| Molecular Weight | 317.179 |
| Exact Mass | 316.042 |
| XLogP3 | 2.7313 |
| Mr | 79.2424 |
| PSA | 75.27 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 35 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCCC(C1(CC(=C)Br)C(=O)NC(=O)NC1=O)C |
