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799820-18-1

799820-18-1 structural image
Product Name: 2-[(4-amino-6-ethyl-6-methyl-5,8-dihydropyrano[4,5]thieno[1,2-c]pyrimidin-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Formula: C22H26N4O2S2
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COMPUTED DESCRIPTORS

Molecular Weight 442.6 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 7
Exact Mass 442.14971843 g/mol
Monoisotopic Mass 442.14971843 g/mol
Topological Polar Surface Area 144 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 592
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes