6391-32-8
Product Name:
2-[[2-Oxo-1-[(2-methoxy-5-sodiosulfophenyl)aminocarbonyl]propyl]azo]-5-[N'-[3-sodiooxycarbonyl-4-[[2-oxo-1-[(4-sodiosulfophenyl)aminocarbonyl]propyl]azo]phenyl]ureido]benzoic acid sodium salt
Formula:
C36H32N8O16S2.4Na
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COMPUTED DESCRIPTORS
| Molecular Weight | 984.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 20 |
| Rotatable Bond Count | 13 |
| Exact Mass | 984.06554631 g/mol |
| Monoisotopic Mass | 984.06554631 g/mol |
| Topological Polar Surface Area | 404 Ų |
| Heavy Atom Count | 66 |
| Formal Charge | 0 |
| Complexity | 1930 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 5 |
| Compound Is Canonicalized | Yes |