Base information
| Cat. No. | |
| CAS No. | 12237-86-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C41H26N4Na2O10S2 |
| Molecular Weight | 844.775 |
| Exact Mass | 844.089 |
| XLogP3 | 8.758 |
| Mr | 206.42 |
| PSA | 275.54 |
| Sequence | - |
| Atom number | 85 |
| Bond number | 90 |
| Ring number | 8 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | Nc1c2C(=O)c3ccccc3C(=O)c2c(cc1S(=O)(=O)[O-])Nc1ccc(cc1)Cc1ccc(cc1)Nc1cc(c(c2c1C(=O)c1ccccc1C2=O)N)S(=O)(=O)[O-].[Na+].[Na+] |
