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842956-27-8

842956-27-8 structural image
Product Name: 2-amino-N-butan-2-yl-1-[(E)-thiophen-2-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide
Formula: C20H20N6OS
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COMPUTED DESCRIPTORS

Molecular Weight 392.5 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 392.14193046 g/mol
Monoisotopic Mass 392.14193046 g/mol
Topological Polar Surface Area 126 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 589
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes