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896593-88-7

896593-88-7 structural image
Product Name: 3-[2-(2-methoxyphenyl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one
Formula: C21H21N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 347.4 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 347.16337692 g/mol
Monoisotopic Mass 347.16337692 g/mol
Topological Polar Surface Area 46.8 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 551
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