6362-40-9
Product Name:
N-[4-[(2,5-Dichlorophenyl)[4-[N-ethyl-N-(3-sodiosulfobenzyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-3-sulfonatobenzenemethanaminium
Formula:
C37H34Cl2N2O6S2.Na
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COMPUTED DESCRIPTORS
| Molecular Weight | 759.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 9 |
| Exact Mass | 758.1054788 g/mol |
| Monoisotopic Mass | 758.1054788 g/mol |
| Topological Polar Surface Area | 137 Ų |
| Heavy Atom Count | 50 |
| Formal Charge | 0 |
| Complexity | 1340 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |