Base information
| Cat. No. | |
| CAS No. | 209268-36-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H31NO4S |
| Molecular Weight | 441.583 |
| Exact Mass | 441.197 |
| XLogP3 | 5.9796 |
| Mr | 125.759 |
| PSA | 114.87 |
| Sequence | - |
| Atom number | 62 |
| Bond number | 65 |
| Ring number | 4 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CCC/C=C\C[C@H]1C[C@H]2C[C@@H]([C@@H]1NC(=O)c1csc3c1cc(O)cc3)C2(C)C |
