Base information
| Cat. No. | |
| CAS No. | 1658-56-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H13N2NaO4S |
| Molecular Weight | 400.383 |
| Exact Mass | 400.049 |
| XLogP3 | 6.0989 |
| Mr | 102.102 |
| PSA | 110.53 |
| Sequence | - |
| Atom number | 41 |
| Bond number | 43 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Oc1ccc2c(c1/N=N/c1ccc(c3c1cccc3)S(=O)(=O)[O-])cccc2.[Na+] |
