Base information
| Cat. No. | |
| CAS No. | 87-08-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H18N2O5S |
| Molecular Weight | 350.39 |
| Exact Mass | 350.094 |
| XLogP3 | 1.0259 |
| Mr | 91.3825 |
| PSA | 121.24 |
| Sequence | - |
| Atom number | 42 |
| Bond number | 44 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | O=C(N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C)COc1ccccc1 |
