Base information
| Cat. No. | |
| CAS No. | 18976-74-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H19ClN4Na2O11S3 |
| Molecular Weight | 669.013 |
| Exact Mass | 667.97 |
| XLogP3 | 5.6691 |
| Mr | 133.317 |
| PSA | 254.91 |
| Sequence | - |
| Atom number | 60 |
| Bond number | 60 |
| Ring number | 3 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1/N=N/c1c(C)nn(c1O)c1c(C)cc(cc1Cl)S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+] |
