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874395-60-5

874395-60-5 structural image
Product Name: 7-bromo-2-(5-methyl-3-isoxazolyl)-1-(4-methylphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Formula: C22H15BrN2O4
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COMPUTED DESCRIPTORS

Molecular Weight 451.3 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 450.02152 g/mol
Monoisotopic Mass 450.02152 g/mol
Topological Polar Surface Area 72.6 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 732
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