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477498-04-7

477498-04-7 structural image
Product Name: 5-chloro-N-(2-((2-cyanoethyl)thio)phenyl)thiophene-2-carboxamide
Formula: C14H11ClN2OS2
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COMPUTED DESCRIPTORS

Molecular Weight 322.8 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 322.0001330 g/mol
Monoisotopic Mass 322.0001330 g/mol
Topological Polar Surface Area 106 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 385
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