Base information
| Cat. No. | |
| CAS No. | 12223-39-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H18N6O4 |
| Molecular Weight | 406.395 |
| Exact Mass | 406.139 |
| XLogP3 | 4.68826 |
| Mr | 109.873 |
| PSA | 147.66 |
| Sequence | - |
| Atom number | 48 |
| Bond number | 49 |
| Ring number | 2 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | N#CCCN(c1ccc(cc1)N=Nc1ccc(cc1C#N)[N+](=O)[O-])CCOC(=O)C |
