Base information
| Cat. No. | |
| CAS No. | 101314-73-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H16IN3O5 |
| Molecular Weight | 409.177 |
| Exact Mass | 409.013 |
| XLogP3 | -0.5645 |
| Mr | 82.4902 |
| PSA | 113.42 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 38 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | ICC(=O)NC[C@H]1O[C@H](C[C@@H]1O)n1cc(C)c(=O)[nH]c1=O |
