Base information
| Cat. No. | |
| CAS No. | 175171-43-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H17N2NaO9S2 |
| Molecular Weight | 516.477 |
| Exact Mass | 516.027 |
| XLogP3 | 4.1503 |
| Mr | 121.522 |
| PSA | 191.98 |
| Sequence | - |
| Atom number | 51 |
| Bond number | 52 |
| Ring number | 3 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CC(=O)Nc1ccc(c(c1)S(=O)(=O)O)C=Cc1ccc(cc1S(=O)(=O)O)N1C(=O)C=CC1=O.[NaH] |
