6362-37-4
Product Name:
N-Methyl-N-[4-[[4-[N-methyl-N-(3-sodiosulfobenzyl)amino]phenyl](4-sulfonatophenyl)methylene]-2,5-cyclohexadien-1-ylidene]-3-sodiosulfobenzenemethanaminium
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COMPUTED DESCRIPTORS
| Molecular Weight | 765.8 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 8 |
| Exact Mass | 765.09870766 g/mol |
| Monoisotopic Mass | 765.09870766 g/mol |
| Topological Polar Surface Area | 200 Ų |
| Heavy Atom Count | 51 |
| Formal Charge | 1 |
| Complexity | 1570 |
| 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 | 3 |
| Compound Is Canonicalized | Yes |