Base information
| Cat. No. | |
| CAS No. | 111479-05-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H22ClN3O5 |
| Molecular Weight | 443.88 |
| Exact Mass | 443.125 |
| XLogP3 | 4.7984 |
| Mr | 117.26 |
| PSA | 92.13 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 55 |
| Ring number | 3 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | O=C([C@H](Oc1ccc(cc1)Oc1cnc2c(n1)ccc(c2)Cl)C)OCCON=C(C)C |
