Base information
| Cat. No. | |
| CAS No. | 86836-02-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H12ClN5O4 |
| Molecular Weight | 361.74 |
| Exact Mass | 361.058 |
| XLogP3 | 2.77898 |
| Mr | 96.0927 |
| PSA | 131.38 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 38 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCN1C(=O)/C(=N/Nc2ccc(cc2[N+](=O)[O-])Cl)/C(=C(C1=O)C#N)C |
