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956818-67-0

956818-67-0 structural image
Product Name: (12bS)-7-(3-ethoxy-4-propoxyphenyl)-12b-methyl-2-(3-phenylpropyl)-2,3,6,7-tetrahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4(12H,12bH)-dione
Formula: C35H39N3O4
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COMPUTED DESCRIPTORS

Molecular Weight 565.7 g/mol
XLogP3 6.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 10
Exact Mass 565.29405673 g/mol
Monoisotopic Mass 565.29405673 g/mol
Topological Polar Surface Area 74.9 Ų
Heavy Atom Count 42
Formal Charge 0
Complexity 939
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes