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429623-43-8

429623-43-8 structural image
Product Name: ethyl 4-[3-(4-chloroanilino)-3-oxopropyl]-1-piperazinecarboxylate
Formula: C16H22ClN3O3
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COMPUTED DESCRIPTORS

Molecular Weight 339.82 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 339.1349693 g/mol
Monoisotopic Mass 339.1349693 g/mol
Topological Polar Surface Area 61.9 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 392
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