Base information
| Cat. No. | |
| CAS No. | 13036-19-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H12N2O |
| Molecular Weight | 236.269 |
| Exact Mass | 236.095 |
| XLogP3 | 3.31748 |
| Mr | 71.345 |
| PSA | 45.38 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1)C=Nc1ccc(cc1)C#N |
