Base information
| Cat. No. | |
| CAS No. | 1391631-21-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H4BrN3O2 |
| Molecular Weight | 205.997 |
| Exact Mass | 204.949 |
| XLogP3 | 0.2758 |
| Mr | 35.9433 |
| PSA | 68.01 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1c(Br)nnn1C |
