Base information
| Cat. No. | |
| CAS No. | 52238-69-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C33H32N10Na2O10S2 |
| Molecular Weight | 838.778 |
| Exact Mass | 838.154 |
| XLogP3 | 7.1136 |
| Mr | 195.294 |
| PSA | 305.49 |
| Sequence | - |
| Atom number | 89 |
| Bond number | 91 |
| Ring number | 5 |
| Rotor number | 17 |
| Residues number | 0 |
| Canonical smiles | OCCN(c1nc(nc(n1)Nc1ccc(cc1OC)/N=N/c1cccc(c1)S(=O)(=O)[O-])Nc1ccc(cc1OC)/N=N/c1cccc(c1)S(=O)(=O)[O-])CCO.[Na+].[Na+] |
