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369607-47-6

369607-47-6 structural image
Product Name: 7-benzyl-2-benzylsulfanyl-3-phenyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one
Formula: C29H25N3OS2
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COMPUTED DESCRIPTORS

Molecular Weight 495.7 g/mol
XLogP3 6.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 495.14390478 g/mol
Monoisotopic Mass 495.14390478 g/mol
Topological Polar Surface Area 89.4 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 757
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