Base information
| Cat. No. | |
| CAS No. | 1539266-14-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H21ClINO4 |
| Molecular Weight | 477.721 |
| Exact Mass | 477.02 |
| XLogP3 | 4.5623 |
| Mr | 107.04 |
| PSA | 48.95 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 47 |
| Ring number | 3 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | COc1cc(I)c(cc1CCNCc1cccc2c1OCO2)OC.Cl |
