Base information
| Cat. No. | |
| CAS No. | 139481-44-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H21N3O3 |
| Molecular Weight | 411.453 |
| Exact Mass | 411.158 |
| XLogP3 | 4.80858 |
| Mr | 118.211 |
| PSA | 77.14 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 55 |
| Ring number | 4 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCOc1nc2c(n1Cc1ccc(cc1)c1ccccc1C#N)c(ccc2)C(=O)OC |
