Base information
| Cat. No. | |
| CAS No. | 1246552-68-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11N3O |
| Molecular Weight | 213.235 |
| Exact Mass | 213.09 |
| XLogP3 | 1.6223 |
| Mr | 63.7222 |
| PSA | 46.92 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 29 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1NCCn2c1cc(n2)c1ccccc1 |
