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799816-14-1

799816-14-1 structural image
Product Name: 2-((5-ethyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-N-(4-phenylbutan-2-yl)acetamide
Formula: C24H27N5OS2
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COMPUTED DESCRIPTORS

Molecular Weight 465.6 g/mol
XLogP3 6.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 8
Exact Mass 465.16570285 g/mol
Monoisotopic Mass 465.16570285 g/mol
Topological Polar Surface Area 126 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 648
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