Base information
| Cat. No. | |
| CAS No. | 1094369-54-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C23H22ClNO6 |
| Molecular Weight | 443.877 |
| Exact Mass | 443.114 |
| XLogP3 | 4.6418 |
| Mr | 115.287 |
| PSA | 86.58 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | O/N=C/1\CC(C)C2(C(=C1)OCc1ccccc1)Oc1c(C2=O)c(OC)cc(c1Cl)OC |
