Base information
| Cat. No. | |
| CAS No. | 1050477-31-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H22N4O3 |
| Molecular Weight | 378.424 |
| Exact Mass | 378.169 |
| XLogP3 | 3.82398 |
| Mr | 108.143 |
| PSA | 110.26 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 52 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCOc1ncc(c2c1[C@@H](C(=C(N2)C)C(=O)N)c1ccc(cc1OC)C#N)C |
