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850905-24-7

850905-24-7 structural image
Product Name: ethyl 2-(2-((2-ethyl-1-oxo-1,2,3,4-tetrahydroisoquinolin-5-yl)oxy)acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Formula: C23H26N2O5S
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COMPUTED DESCRIPTORS

Molecular Weight 442.5 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 8
Exact Mass 442.15624311 g/mol
Monoisotopic Mass 442.15624311 g/mol
Topological Polar Surface Area 113 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 689
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