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312275-77-7

312275-77-7 structural image
Product Name: 2-amino-4-[4-(dimethylamino)phenyl]-7,7-dimethyl-5-oxo-1-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
Formula: C26H28N4O
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COMPUTED DESCRIPTORS

Molecular Weight 412.5 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 412.22631153 g/mol
Monoisotopic Mass 412.22631153 g/mol
Topological Polar Surface Area 73.4 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 829
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes