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149550-67-4

149550-67-4 structural image
Product Name: 2-AMINO-4-(1,3-BENZODIOXOL-5-YL)-4H-BENZO[H]CHROMENE-3-CARBONITRILE
Formula: C21H14N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 342.3 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 342.10044231 g/mol
Monoisotopic Mass 342.10044231 g/mol
Topological Polar Surface Area 77.5 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 638
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