31675-93-1
Product Name:
3-[[4-[[8-(benzoylamino)-1-hydroxy-3,6-disulpho-2-naphthyl]azo]-2,5-dimethoxyphenyl]azo]-4-hydroxy-5-[[4-(methylsulphonyl)benzoyl]amino]naphthalene-2,7-disulphonic acid
Formula:
C43H34N6O20S5
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COMPUTED DESCRIPTORS
| Molecular Weight | 1115.1 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 8 |
| Hydrogen Bond Acceptor Count | 24 |
| Rotatable Bond Count | 15 |
| Exact Mass | 1114.04314336 g/mol |
| Monoisotopic Mass | 1114.04314336 g/mol |
| Topological Polar Surface Area | 460 Ų |
| Heavy Atom Count | 74 |
| Formal Charge | 0 |
| Complexity | 2640 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |