Base information
| Cat. No. | |
| CAS No. | 1217230-31-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H22N4O4 |
| Molecular Weight | 446.437 |
| Exact Mass | 446.178 |
| XLogP3 | 3.8524 |
| Mr | 127.69 |
| PSA | 116.55 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 58 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cccc(c1)C1=CC=C/C(=N\N[13c]2[13c]([13CH3])[nH]n([13c]2=O)c2ccc(c(c2)C)C)/C1=O |
