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585549-06-0

585549-06-0 structural image
Product Name: ethyl 2-(2-((3-allyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)acetamido)acetate
Formula: C17H21N3O4S2
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COMPUTED DESCRIPTORS

Molecular Weight 395.5 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 9
Exact Mass 395.09734851 g/mol
Monoisotopic Mass 395.09734851 g/mol
Topological Polar Surface Area 142 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 611
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