Base information
| Cat. No. | |
| CAS No. | 1245643-11-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9BrN2O2 |
| Molecular Weight | 245.073 |
| Exact Mass | 243.985 |
| XLogP3 | 2.5625 |
| Mr | 54.2303 |
| PSA | 78.34 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc(N)c(c(c1)Br)N |
