Base information
| Cat. No. | |
| CAS No. | 380380-60-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H4BrN5 |
| Molecular Weight | 226.033 |
| Exact Mass | 224.965 |
| XLogP3 | 1.0242 |
| Mr | 45.1087 |
| PSA | 67.35 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 17 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc(nc1)c1n[nH]nn1 |
