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861207-00-3

861207-00-3 structural image
Product Name: 2-METHYL-2-(3-[4-(TRIFLUOROMETHYL)PHENYL]-1,2,4-OXADIAZOL-5-YL)-2H-1,4-BENZOXAZIN-3(4H)-ONE
Formula: C18H12F3N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 375.3 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 2
Exact Mass 375.08307574 g/mol
Monoisotopic Mass 375.08307574 g/mol
Topological Polar Surface Area 77.2 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 568
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes