5915-59-3
Product Name:
sodium 2-[4-[[2,4-dihydroxy-3-(phenylazo)phenyl]azo]phenyl]-6-methylbenzothiazole-7-sulphonate
Formula:
C26H18N5NaO5S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 567.6 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 6 |
| Exact Mass | 567.06470532 g/mol |
| Monoisotopic Mass | 567.06470532 g/mol |
| Topological Polar Surface Area | 190 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 1110 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |