Base information
| Cat. No. | |
| CAS No. | 159453-24-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H17NO4S |
| Molecular Weight | 331.386 |
| Exact Mass | 331.088 |
| XLogP3 | 3.5492 |
| Mr | 88.1255 |
| PSA | 100.93 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 41 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | O=C(N[C@H](C(=O)O)CSc1ccccc1)OCc1ccccc1 |
