Base information
| Cat. No. | |
| CAS No. | 1229705-06-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C31H29Cl2F2N3O4 |
| Molecular Weight | 616.482 |
| Exact Mass | 615.15 |
| XLogP3 | 7.34068 |
| Mr | 160.354 |
| PSA | 111.45 |
| Sequence | - |
| Atom number | 71 |
| Bond number | 74 |
| Ring number | 4 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1NC(=O)[C@@H]1N[C@H]([C@]([C@H]1c1cccc(c1F)Cl)(C#N)c1ccc(cc1F)Cl)CC(C)(C)C)C(=O)O |
