Base information
| Cat. No. | |
| CAS No. | 1229208-44-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C23H21N7O |
| Molecular Weight | 411.459 |
| Exact Mass | 411.181 |
| XLogP3 | 3.9908 |
| Mr | 123.345 |
| PSA | 83.37 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 57 |
| Ring number | 6 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O1CCN(CC1)c1ccc(cc1)Nc1nc(cn2c1ncc2)c1ccc2c(c1)[nH]nc2 |
