Base information
| Cat. No. | |
| CAS No. | 62570-50-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H13N3O2 |
| Molecular Weight | 291.304 |
| Exact Mass | 291.101 |
| XLogP3 | 3.00188 |
| Mr | 82.9811 |
| PSA | 95.98 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 37 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CCNc1cc(C#N)c(c2c1C(=O)c1c(C2=O)cccc1)N |
