Base information
| Cat. No. | |
| CAS No. | 745047-97-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H21N3O3 |
| Molecular Weight | 327.378 |
| Exact Mass | 327.158 |
| XLogP3 | 2.1555 |
| Mr | 90.3794 |
| PSA | 80.32 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 46 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | COc1cc(C)ccc1CNC(=O)C(=O)NCCc1ccccn1 |
