113216-88-9
Product Name:
HYDROQUININE 4-CHLOROBENZOATE
Formula:
C27H29ClN2O3
Synonyms:
Dihydroquinine 4-chlorobenzoate;Hydroquinine 4-chlorobenzoate
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COMPUTED DESCRIPTORS
Molecular Weight | 465.0 g/mol |
---|---|
XLogP3 | 5.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 7 |
Exact Mass | 464.1866705 g/mol |
Monoisotopic Mass | 464.1866705 g/mol |
Topological Polar Surface Area | 51.7 Ų |
Heavy Atom Count | 33 |
Formal Charge | 0 |
Complexity | 670 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 4 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |