Base information
| Cat. No. | |
| CAS No. | 168434-02-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H16N6O3 |
| Molecular Weight | 412.401 |
| Exact Mass | 412.128 |
| XLogP3 | 2.9232 |
| Mr | 113.875 |
| PSA | 129.55 |
| Sequence | - |
| Atom number | 47 |
| Bond number | 51 |
| Ring number | 5 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cccc2c1n(Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)c(=O)[nH]2 |
