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439108-64-2

439108-64-2 structural image
Product Name: 4-(4-HEPTYLPHENYL)-2-METHYL-5-OXO-5H-INDENO[1,2-B]PYRIDINE-3-CARBONITRILE
Formula: C27H26N2O
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COMPUTED DESCRIPTORS

Molecular Weight 394.5 g/mol
XLogP3 7.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 7
Exact Mass 394.204513457 g/mol
Monoisotopic Mass 394.204513457 g/mol
Topological Polar Surface Area 53.8 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 628
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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