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306286-94-2

306286-94-2 structural image
Product Name: 2,7,7-TRIMETHYL-5-OXO-4-(3-PYRIDINYL)-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBONITRILE
Formula: C18H19N3O
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COMPUTED DESCRIPTORS

Molecular Weight 293.4 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 293.152812238 g/mol
Monoisotopic Mass 293.152812238 g/mol
Topological Polar Surface Area 65.8 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 618
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