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397276-02-7

397276-02-7 structural image
Product Name: 3-(4-TRIFLUOROMETHOXYPHENYL)-2-THIOXO-1,3-DIHYDROQUINAZOLIN-4-ONE
Formula: C15H9F3N2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 338.31 g/mol
XLogP3 4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 2
Exact Mass 338.03368319 g/mol
Monoisotopic Mass 338.03368319 g/mol
Topological Polar Surface Area 73.7 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 478
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