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299198-01-9

299198-01-9 structural image
Product Name: 3-AMINO-6-THIOPHEN-2-YL-4-TRIFLUOROMETHYL-THIENO[2,3-B]PYRIDINE-2-CARBONITRILE
Formula: C13H6F3N3S2
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COMPUTED DESCRIPTORS

Molecular Weight 325.3 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 1
Exact Mass 324.99552404 g/mol
Monoisotopic Mass 324.99552404 g/mol
Topological Polar Surface Area 119 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 450
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