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601462-80-0

601462-80-0 structural image
Product Name: 7-Isoquinolineethanamine,1,2,3,4-tetrahydro-6-methoxy-N,N-dimethyl-1-(2-quinoxalinyl)-(9CI)
Formula: C22H26N4O
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COMPUTED DESCRIPTORS

Molecular Weight 362.5 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 362.21066147 g/mol
Monoisotopic Mass 362.21066147 g/mol
Topological Polar Surface Area 50.3 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 473
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