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421578-46-3

421578-46-3 structural image
Product Name: 2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-(4-fluorophenyl)ethanone
Formula: C16H13FN2OS2
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COMPUTED DESCRIPTORS

Molecular Weight 332.4 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 332.04533355 g/mol
Monoisotopic Mass 332.04533355 g/mol
Topological Polar Surface Area 96.4 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 404
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