Base information
| Cat. No. | |
| CAS No. | 81461-73-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H19BrN4 |
| Molecular Weight | 299.21 |
| Exact Mass | 298.079 |
| XLogP3 | -2.065 |
| Mr | 80.583 |
| PSA | 29.02 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 37 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | C1CC[N+]2(C1)CCN(CC2)c1ncccn1.[Br-] |
