Base information
| Cat. No. | |
| CAS No. | 100427-26-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C36H41N3O6 |
| Molecular Weight | 611.727 |
| Exact Mass | 611.3 |
| XLogP3 | 7.3304 |
| Mr | 180.082 |
| PSA | 113.69 |
| Sequence | - |
| Atom number | 86 |
| Bond number | 89 |
| Ring number | 4 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | COC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC(CN(CCC(c1ccccc1)c1ccccc1)C)(C)C)C |
