Base information
| Cat. No. | |
| CAS No. | 4277-43-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H24INO4 |
| Molecular Weight | 469.313 |
| Exact Mass | 469.075 |
| XLogP3 | -0.0255 |
| Mr | 115.887 |
| PSA | 58.92 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 52 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(-c3c(O)c(OC)cc4c3C(C2)[N+](C)(C)CC4)c1O.[I-] |
