Base information
| Cat. No. | |
| CAS No. | 12239-03-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C32H28CrN10NaO8S2- |
| Molecular Weight | 819.743 |
| Exact Mass | 819.084 |
| XLogP3 | 7.6186 |
| Mr | 188.057 |
| PSA | 296.76 |
| Sequence | - |
| Atom number | 82 |
| Bond number | 84 |
| Ring number | 6 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | Oc1ccc(cc1/N=N\[c-]1c(C)nn(c1=O)c1ccccc1)S(=O)(=O)N.Oc1ccc(cc1/N=N\[c-]1c(C)nn(c1=O)c1ccccc1)S(=O)(=O)N.[Na+].[Cr] |
