Base information
| Cat. No. | |
| CAS No. | 69861-89-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H27ClN2O3S |
| Molecular Weight | 422.969 |
| Exact Mass | 422.143 |
| XLogP3 | 5.7636 |
| Mr | 116.29 |
| PSA | 106.72 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 55 |
| Ring number | 2 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)SCc1ccccc1)NC(=O)OCc1ccccc1.Cl |
