Base information
| Cat. No. | |
| CAS No. | 1211584-18-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7BrN4 |
| Molecular Weight | 227.061 |
| Exact Mass | 225.985 |
| XLogP3 | 2.1922 |
| Mr | 50.9591 |
| PSA | 67.59 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1nc2[nH]nc(c2cc1Br)N |
