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439107-98-9

439107-98-9 structural image
Product Name: (5-BROMO-1-BENZOTHIOPHEN-2-YL)(MORPHOLINO)METHANONE
Formula: C13H12BrNO2S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 45.8 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 326.21 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 324.97721 g/mol
Monoisotopic Mass 324.97721 g/mol
Topological Polar Surface Area 57.8 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 322
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