Base information
| Cat. No. | |
| CAS No. | 24565-13-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C36H34N12Na2O6S2 |
| Molecular Weight | 840.841 |
| Exact Mass | 840.196 |
| XLogP3 | 8.4728 |
| Mr | 210.997 |
| PSA | 280.68 |
| Sequence | - |
| Atom number | 92 |
| Bond number | 95 |
| Ring number | 6 |
| Rotor number | 16 |
| Residues number | 0 |
| Canonical smiles | CCNc1nc(nc(n1)Nc1ccccc1)Nc1ccc(c(c1)S(=O)(=O)[O-])/C=C/c1ccc(cc1S(=O)(=O)[O-])Nc1nc(NCC)nc(n1)Nc1ccccc1.[Na+].[Na+] |
