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477711-24-3

477711-24-3 structural image
Product Name: 4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-2-(3-[4-(DIMETHYLAMINO)PHENYL]-2-PROPENYLIDENE)-5-OXO-2,5-DIHYDROISOXAZOL-2-IUM-3-OLATE
Formula: C20H15ClF3N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 437.8 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 437.0754035 g/mol
Monoisotopic Mass 437.0754035 g/mol
Topological Polar Surface Area 68.5 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 881
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes