Base information
| Cat. No. | |
| CAS No. | 155790-01-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H8BrN3O2 |
| Molecular Weight | 246.061 |
| Exact Mass | 244.98 |
| XLogP3 | 2.6986 |
| Mr | 55.0307 |
| PSA | 70.74 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CNc1ncc(c(c1[N+](=O)[O-])C)Br |
