Base information
| Cat. No. | |
| CAS No. | 65212-77-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H14CaCl2N4O7S2 |
| Molecular Weight | 549.419 |
| Exact Mass | 547.931 |
| XLogP3 | 5.249 |
| Mr | 120.158 |
| PSA | 182.89 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 47 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CC1=NN(C(=O)C1/N=N/c1cc(Cl)c(cc1S(=O)(=O)O)Cl)c1cccc(c1)S(=O)(=O)O.[CaH2] |
