Base information
| Cat. No. | |
| CAS No. | 1217698-68-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H22N2O4 |
| Molecular Weight | 330.378 |
| Exact Mass | 330.158 |
| XLogP3 | 2.89298 |
| Mr | 92.4118 |
| PSA | 90.63 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 47 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc(cc1)C[C@@]1(CCCN1C(=O)OC(C)(C)C)C(=O)O |
