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457629-96-8

457629-96-8 structural image
Product Name: Pyrrolidine, 3-butyl-2-methylene-1-[(4-methylphenyl)sulfonyl]-3-phenyl-
Formula: C22H27NO2S
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COMPUTED DESCRIPTORS

Molecular Weight 369.5 g/mol
XLogP3 5.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 369.17625028 g/mol
Monoisotopic Mass 369.17625028 g/mol
Topological Polar Surface Area 45.8 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 580
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes