Base information
| Cat. No. | |
| CAS No. | 1345866-65-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6N4O2 |
| Molecular Weight | 202.17 |
| Exact Mass | 202.049 |
| XLogP3 | 0.6318 |
| Mr | 50.0173 |
| PSA | 88.86 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1ccc(cc1)c1nncnn1 |
