Base information
| Cat. No. | |
| CAS No. | 139756-21-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H20N4O2 |
| Molecular Weight | 312.366 |
| Exact Mass | 312.159 |
| XLogP3 | 2.6748 |
| Mr | 90.7257 |
| PSA | 72.8 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 45 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCCc1nn(c2c1nc([nH]c2=O)c1ccccc1OCC)C |
