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312272-81-4

312272-81-4 structural image
Product Name: 2-amino-1-(4-chlorophenyl)-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
Formula: C25H24ClN3O2
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COMPUTED DESCRIPTORS

Molecular Weight 433.9 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 433.1557047 g/mol
Monoisotopic Mass 433.1557047 g/mol
Topological Polar Surface Area 79.4 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 836
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