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338403-28-4

338403-28-4 structural image
Product Name: 4-[(3,5-DICHLOROANILINO)METHYLENE]-2-[4-(TRIFLUOROMETHOXY)PHENYL]-5-(TRIFLUOROMETHYL)-2,4-DIHYDRO-3H-PYRAZOL-3-ONE
Formula: C18H9Cl2F6N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 484.2 g/mol
XLogP3 6.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 4
Exact Mass 482.9976009 g/mol
Monoisotopic Mass 482.9976009 g/mol
Topological Polar Surface Area 53.9 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 725
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