Base information
| Cat. No. | |
| CAS No. | 10190-68-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H20N4Na2O9S3 |
| Molecular Weight | 662.622 |
| Exact Mass | 662.019 |
| XLogP3 | 6.835 |
| Mr | 147.454 |
| PSA | 255.57 |
| Sequence | - |
| Atom number | 63 |
| Bond number | 64 |
| Ring number | 4 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | COc1ccccc1NC(=O)/C(=C(/O)\C)/N=N/c1ccc(cc1S(=O)(=O)[O-])c1nc2c(s1)c(c(cc2)C)S(=O)(=O)[O-].[Na+].[Na+] |
