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496772-61-3

496772-61-3 structural image
Product Name: methyl 2-((8,8-dimethyl-4-oxo-3-(p-tolyl)-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)acetate
Formula: C22H23N3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 425.5 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 425.14092740 g/mol
Monoisotopic Mass 425.14092740 g/mol
Topological Polar Surface Area 106 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 705
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