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840516-86-1

840516-86-1 structural image
Product Name: heptyl 2-amino-1-(1-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Formula: C26H30N4O2
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COMPUTED DESCRIPTORS

Molecular Weight 430.5 g/mol
XLogP3 6.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 10
Exact Mass 430.23687621 g/mol
Monoisotopic Mass 430.23687621 g/mol
Topological Polar Surface Area 83 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 596
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