Base information
| Cat. No. | |
| CAS No. | 445473-58-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H32N2O4S |
| Molecular Weight | 348.501 |
| Exact Mass | 348.208 |
| XLogP3 | 4.0172 |
| Mr | 94.0454 |
| PSA | 83.62 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 54 |
| Ring number | 1 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | CCCCn1cc[n+](c1)C.CCCCCCCCOS(=O)(=O)[O-] |
