Base information
| Cat. No. | |
| CAS No. | 110428-56-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H30ClNO4 |
| Molecular Weight | 395.92 |
| Exact Mass | 395.186 |
| XLogP3 | 3.4585 |
| Mr | 105.083 |
| PSA | 97.46 |
| Sequence | - |
| Atom number | 57 |
| Bond number | 59 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NCC(=O)[C@@]1(O)CC[C@@H]2[C@]1(C)CC(=O)[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C.Cl |
