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851864-02-3

851864-02-3 structural image
Product Name: (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(2,6-difluorophenyl)methanone
Formula: C17H14F2N2OS
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 18.5 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 332.4 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 332.07949057 g/mol
Monoisotopic Mass 332.07949057 g/mol
Topological Polar Surface Area 58 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 444
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