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942666-52-6

942666-52-6 structural image
Product Name: 1-[(5-chloro-2-ethoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylic acid
Formula: C15H20ClNO5S
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COMPUTED DESCRIPTORS

Molecular Weight 361.8 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 361.0750716 g/mol
Monoisotopic Mass 361.0750716 g/mol
Topological Polar Surface Area 92.3 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 513
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