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344276-97-7

344276-97-7 structural image
Product Name: 1-[5-(([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)METHYL)-4,5-DIHYDRO-3-ISOXAZOLYL]-3-[4-(TRIFLUOROMETHOXY)ANILINO]-2-PROPEN-1-ONE
Formula: C20H15ClF6N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 508.8 g/mol
XLogP3 5.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 8
Exact Mass 508.0736870 g/mol
Monoisotopic Mass 508.0736870 g/mol
Topological Polar Surface Area 84.8 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 756
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes