Base information
| Cat. No. | |
| CAS No. | 1597407-55-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H29N3O4 |
| Molecular Weight | 399.483 |
| Exact Mass | 399.216 |
| XLogP3 | 2.68988 |
| Mr | 114.577 |
| PSA | 86.03 |
| Sequence | - |
| Atom number | 58 |
| Bond number | 61 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | N#C[C@]1(CCC[C@H]2N1[C@H](CO2)c1ccccc1)C1(O)CN(C1)C(=O)OC(C)(C)C |
