Base information
| Cat. No. | |
| CAS No. | 21314-17-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H8N4O |
| Molecular Weight | 212.207 |
| Exact Mass | 212.07 |
| XLogP3 | 1.1088 |
| Mr | 59.4857 |
| PSA | 63.57 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 26 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=c1[nH]cnc2c1cnn2c1ccccc1 |
