Base information
| Cat. No. | |
| CAS No. | 4329-78-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H9N5 |
| Molecular Weight | 223.233 |
| Exact Mass | 223.086 |
| XLogP3 | 1.9287 |
| Mr | 62.8447 |
| PSA | 67.35 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 28 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | n1ccc(cc1)c1[nH]nc(n1)c1ccncc1 |
