Base information
| Cat. No. | |
| CAS No. | 141527-79-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H27NO7S |
| Molecular Weight | 449.517 |
| Exact Mass | 449.151 |
| XLogP3 | 4.8087 |
| Mr | 114.329 |
| PSA | 116.38 |
| Sequence | - |
| Atom number | 58 |
| Bond number | 59 |
| Ring number | 2 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | O=C(OC(C)(C)C)N[C@@H](C(=O)OCc1ccccc1)COS(=O)(=O)c1ccc(cc1)C |
