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1024572-83-5

1024572-83-5 structural image
Product Name: 1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-((2-METHOXYPHENYL)METHYL)THIOUREA
Formula: C17H14F6N2OS
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COMPUTED DESCRIPTORS

Molecular Weight 408.4 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 408.07310322 g/mol
Monoisotopic Mass 408.07310322 g/mol
Topological Polar Surface Area 65.4 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 477
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