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478246-16-1

478246-16-1 structural image
Product Name: METHYL 5-CYANO-1-(4-FLUOROPHENYL)-4-[(E)-2-(4-METHOXYANILINO)ETHENYL]-6-OXO-1,6-DIHYDRO-3-PYRIDAZINECARBOXYLATE
Formula: C22H17FN4O4
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COMPUTED DESCRIPTORS

Molecular Weight 420.4 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 7
Exact Mass 420.12338320 g/mol
Monoisotopic Mass 420.12338320 g/mol
Topological Polar Surface Area 104 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 828
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