Base information
| Cat. No. | |
| CAS No. | 701232-20-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H26N4O3 |
| Molecular Weight | 394.467 |
| Exact Mass | 394.2 |
| XLogP3 | 4.1159 |
| Mr | 115.761 |
| PSA | 110.69 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 58 |
| Ring number | 4 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C[C@@H]1CC[C@H](CC1)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C |
