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799791-29-0

799791-29-0 structural image
Product Name: 2-[3-(4-chlorophenyl)-6,6-dimethyl-2,4-dioxo-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-1-yl]acetamide
Formula: C19H18ClN3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 419.9 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 419.0706549 g/mol
Monoisotopic Mass 419.0706549 g/mol
Topological Polar Surface Area 121 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 682
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