Base information
| Cat. No. | |
| CAS No. | 612835-51-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H8BrN3O2 |
| Molecular Weight | 246.061 |
| Exact Mass | 244.98 |
| XLogP3 | 1.5792 |
| Mr | 50.2229 |
| PSA | 78.1 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1nc(Br)cnc1N |
