Base information
| Cat. No. | |
| CAS No. | 2040291-27-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H18N4O4 |
| Molecular Weight | 342.349 |
| Exact Mass | 342.133 |
| XLogP3 | 0.9475 |
| Mr | 89.3658 |
| PSA | 126.65 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 46 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O[C@@H]([C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc2c1ncnc2N)c1ccccc1 |
