Base information
| Cat. No. | |
| CAS No. | 54260-72-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H20ClNO4 |
| Molecular Weight | 385.841 |
| Exact Mass | 385.108 |
| XLogP3 | 0.4087 |
| Mr | 105.693 |
| PSA | 40.8 |
| Sequence | - |
| Atom number | 47 |
| Bond number | 50 |
| Ring number | 5 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1c(OC)ccc2c1c[n+]1CCc3c(-c1c2C)cc1c(c3)OCO1.[Cl-] |
