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477872-59-6

477872-59-6 structural image
Product Name: Pyrimidine, 5-methoxy-4-[(4-methoxyphenyl)thio]-2-phenyl-
Formula: C18H16N2O2S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility <0.3 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 324.4 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 324.09324893 g/mol
Monoisotopic Mass 324.09324893 g/mol
Topological Polar Surface Area 69.5 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 344
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