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848685-22-3

848685-22-3 structural image
Product Name: tetrahydrofuran-2-ylmethyl 2-amino-1-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Formula: C21H20N4O3S
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COMPUTED DESCRIPTORS

Molecular Weight 408.5 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 408.12561169 g/mol
Monoisotopic Mass 408.12561169 g/mol
Topological Polar Surface Area 121 Ų
Heavy Atom Count 29
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