Base information
| Cat. No. | |
| CAS No. | 33308-41-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C32H18N8O12S4 |
| Molecular Weight | 834.792 |
| Exact Mass | 833.993 |
| XLogP3 | 3.2028 |
| Mr | 216.653 |
| PSA | 356.74 |
| Sequence | - |
| Atom number | 74 |
| Bond number | 82 |
| Ring number | 9 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OS(=O)(=O)c1ccc2c(c1)C1=N/C/2=N\c2[nH]c(c3c2cc(cc3)S(=O)(=O)O)/N=C/2\N=C(/N=c/3\[nH]/c(=N\1)/c1ccc(cc31)S(=O)(=O)O)c1c2cc(cc1)S(=O)(=O)O |
