Base information
| Cat. No. | |
| CAS No. | 123653-11-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H18N2O5S |
| Molecular Weight | 314.357 |
| Exact Mass | 314.094 |
| XLogP3 | 4.3548 |
| Mr | 81.9467 |
| PSA | 109.6 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 40 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1ccc(c(c1)OC1CCCCC1)NS(=O)(=O)C |
