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112290-21-8

112290-21-8 structural image
Product Name: 2-(4-Chlorophenoxyacetylamino)-3-ethoxycarbonylthieno(2,3-b)quinuclidi ne
Formula: C20H21ClN2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 420.9 g/mol
XLogP3 5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 420.0910560 g/mol
Monoisotopic Mass 420.0910560 g/mol
Topological Polar Surface Area 96.1 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 579
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