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338399-46-5

338399-46-5 structural image
Product Name: 1-[[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL](METHYL)AMINO]-2,4-DIOXO-3-(2-[3-(TRIFLUOROMETHYL)PHENOXY]ETHYL)-1,2,3,4-TETRAHYDRO-5-PYRIMIDINECARBONITRILE
Formula: C21H14ClF6N5O3
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COMPUTED DESCRIPTORS

Molecular Weight 533.8 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 6
Exact Mass 533.0689360 g/mol
Monoisotopic Mass 533.0689360 g/mol
Topological Polar Surface Area 89.8 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 920
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