Base information
| Cat. No. | |
| CAS No. | 12220-30-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C23H19ClN3NaO6S2 |
| Molecular Weight | 555.986 |
| Exact Mass | 555.03 |
| XLogP3 | 8.4396 |
| Mr | 133.878 |
| PSA | 176.24 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 57 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc(c(c1)/N=N/c1c(N)ccc2c1c(O)cc(c2)S(=O)(=O)O)S(=O)(=O)c1ccc(cc1)C.[NaH] |
