This compound belongs to the class of organic compounds known as phenylquinolines. These are heterocyclic compounds containing a quinoline moiety substituted with a phenyl group.
External Descriptors
Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Solvent:ethanol, Max Conc. mg/mL: 46.86, Max Conc. mM: 100; Solvent:DMSO, Max Conc. mg/mL: 9.37, Max Conc. mM: 20
Molecular Weight
468.600 g/mol
XLogP3
7.300
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
7
Exact Mass
468.278 Da
Monoisotopic Mass
468.278 Da
Topological Polar Surface Area
49.400 Ų
Heavy Atom Count
35
Formal Charge
0
Complexity
800.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
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