Base information
| Cat. No. | |
| CAS No. | 1211538-71-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9BrN2O2 |
| Molecular Weight | 245.073 |
| Exact Mass | 243.985 |
| XLogP3 | 1.7454 |
| Mr | 52.5222 |
| PSA | 51.22 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1ncc(cc1NC)Br |
