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797772-40-8

797772-40-8 structural image
Product Name: butyl 2-amino-1-(3-chloro-4-fluorophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate
Formula: C21H18ClFN4O2
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COMPUTED DESCRIPTORS

Molecular Weight 412.8 g/mol
XLogP3 5.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 412.1102317 g/mol
Monoisotopic Mass 412.1102317 g/mol
Topological Polar Surface Area 83 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 585
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