Base information
| Cat. No. | |
| CAS No. | 27825-22-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H4BrN3O |
| Molecular Weight | 202.009 |
| Exact Mass | 200.954 |
| XLogP3 | 1.0383 |
| Mr | 37.8269 |
| PSA | 68.87 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | NC(=O)c1nccnc1Br |
