6222-60-2
Product Name:
disodium 2'-[4-[[1-hydroxy-7-(phenylamino)-3-sulphonato-2-naphthyl]azo]phenyl]-6-methyl[2,6'-bibenzothiazole]-7-sulphonate
Formula:
C37H26N5NaO7S4
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COMPUTED DESCRIPTORS
| Molecular Weight | 823.9 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 6 |
| Exact Mass | 823.02757135 g/mol |
| Monoisotopic Mass | 823.02757135 g/mol |
| Topological Polar Surface Area | 270 Ų |
| Heavy Atom Count | 55 |
| Formal Charge | 0 |
| Complexity | 1490 |
| 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 |