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1332612-57-3

1332612-57-3 structural image
Product Name: Thieno[3,2-c]pyridine-5(4H)-acetic acid, α-(2-chlorophenyl)-6,7-dihydro-, (αS)-, ethyl ester, sulfate (1:1)
Formula: C17H20ClNO6S2
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COMPUTED DESCRIPTORS

Molecular Weight 433.9 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 5
Exact Mass 433.0420574 g/mol
Monoisotopic Mass 433.0420574 g/mol
Topological Polar Surface Area 141 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 476
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes