Base information
| Cat. No. | |
| CAS No. | 1154028-82-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H14N8O2 |
| Molecular Weight | 314.303 |
| Exact Mass | 314.124 |
| XLogP3 | -0.5621 |
| Mr | 82.6237 |
| PSA | 106.75 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 40 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=c1n([nH]cc1n1ccnn1)c1ncnc(c1)N1CCOCC1 |
