Base information
| Cat. No. | |
| CAS No. | 6459-69-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C40H34N4Na2O12S2 |
| Molecular Weight | 872.827 |
| Exact Mass | 872.141 |
| XLogP3 | 10.8834 |
| Mr | 211.038 |
| PSA | 279.98 |
| Sequence | - |
| Atom number | 94 |
| Bond number | 98 |
| Ring number | 7 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1/N=N/c1c(O)c2cc(O)ccc2cc1S(=O)(=O)[O-])C1(CCCCC1)c1ccc(c(c1)OC)/N=N/c1c(O)c2cc(O)ccc2cc1S(=O)(=O)[O-].[Na+].[Na+] |
