Base information
| Cat. No. | |
| CAS No. | 33401-94-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H20N2O6S |
| Molecular Weight | 356.394 |
| Exact Mass | 356.104 |
| XLogP3 | -0.2538 |
| Mr | 97.3622 |
| PSA | 158.9 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 44 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | O[C@H]([C@H](C(=O)O)O)C(=O)O.CN1CCCN=C1/C=C/c1cccs1 |
