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845986-51-8

845986-51-8 structural image
Product Name: N-benzhydryl-2-[(7-methyl-2-methylsulfanyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-yl)sulfanyl]acetamide
Formula: C26H26N4OS3
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COMPUTED DESCRIPTORS

Molecular Weight 506.7 g/mol
XLogP3 5.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 7
Exact Mass 506.12687499 g/mol
Monoisotopic Mass 506.12687499 g/mol
Topological Polar Surface Area 137 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 654
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