Base information
| Cat. No. | |
| CAS No. | 547-58-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H14N3NaO3S |
| Molecular Weight | 327.334 |
| Exact Mass | 327.065 |
| XLogP3 | 4.1529 |
| Mr | 79.2744 |
| PSA | 93.54 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 36 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CN(c1ccc(cc1)/N=N/c1ccc(cc1)S(=O)(=O)[O-])C.[Na+] |
