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606947-42-6

606947-42-6 structural image
Product Name: 5-(1,3-benzodioxol-5-ylmethylamino)-2-[(2-chlorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
Formula: C19H14ClN3O4
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COMPUTED DESCRIPTORS

Molecular Weight 383.8 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 383.0672836 g/mol
Monoisotopic Mass 383.0672836 g/mol
Topological Polar Surface Area 89.5 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 544
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