Base information
| Cat. No. | |
| CAS No. | 5873-16-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H27N2NaO7S2 |
| Molecular Weight | 554.611 |
| Exact Mass | 554.116 |
| XLogP3 | 7.5854 |
| Mr | 140.699 |
| PSA | 165.53 |
| Sequence | - |
| Atom number | 64 |
| Bond number | 66 |
| Ring number | 4 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCNc1cc2[o+]c3cc(NCC)c(cc3c(c2cc1C)c1ccc(cc1S(=O)(=O)[O-])S(=O)(=O)O)C.[NaH] |
