Base information
| Cat. No. | |
| CAS No. | 176849-91-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H22IN3O2 |
| Molecular Weight | 403.259 |
| Exact Mass | 403.076 |
| XLogP3 | 3.0061 |
| Mr | 96.5906 |
| PSA | 67.59 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 44 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCN1CCCC1CNC(=O)c1cc(I)c(cc1OC)N |
