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338964-28-6

338964-28-6 structural image
Product Name: 4,6-DIMETHYL-3-[(4-METHYLPHENYL)SULFONYL]-2(1H)-PYRIDINONE
Formula: C14H15NO3S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >41.6 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 277.34 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 277.07726451 g/mol
Monoisotopic Mass 277.07726451 g/mol
Topological Polar Surface Area 71.6 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 544
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