1177131-02-0
Product Name:
sodium (E)-4-((3-(4-nitrophenyl)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)diazenyl)benzenesulfonate
Formula:
C21H16N5NaO6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 487.4 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 487.05624864 g/mol |
| Monoisotopic Mass | 487.05624864 g/mol |
| Topological Polar Surface Area | 169 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 889 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |