Base information
| Cat. No. | |
| CAS No. | 12226-45-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H15Cl2N6NaO6S2 |
| Molecular Weight | 593.395 |
| Exact Mass | 591.977 |
| XLogP3 | 7.6395 |
| Mr | 133.31 |
| PSA | 200.92 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 54 |
| Ring number | 4 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | Clc1nc(Nc2ccc(c(c2)C)/N=N/c2cc3c(c(c2)S(=O)(=O)O)cccc3S(=O)(=O)O)nc(n1)Cl.[NaH] |
