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338976-05-9

338976-05-9 structural image
Product Name: PHENYL 4-OXO-3-[3-(TRIFLUOROMETHYL)PHENYL]-3,4-DIHYDRO-1-PHTHALAZINECARBOXYLATE
Formula: C22H13F3N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 410.3 g/mol
XLogP3 5.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 4
Exact Mass 410.08782677 g/mol
Monoisotopic Mass 410.08782677 g/mol
Topological Polar Surface Area 59 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 688
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