Base information
| Cat. No. | |
| CAS No. | 116861-00-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H22N2O2 |
| Molecular Weight | 274.358 |
| Exact Mass | 274.168 |
| XLogP3 | 2.6059 |
| Mr | 80.2595 |
| PSA | 46.42 |
| Sequence | - |
| Atom number | 42 |
| Bond number | 43 |
| Ring number | 2 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | OC(COc1ccccc1n1cccc1)CNC(C)C |