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899731-12-5

899731-12-5 structural image
Product Name: 4-ethyl-N-[2-(3-fluoro-4-methylbenzoyl)-1-benzofuran-3-yl]thiadiazole-5-carboxamide
Formula: C21H16FN3O3S
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COMPUTED DESCRIPTORS

Molecular Weight 409.4 g/mol
XLogP3 5.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 409.08964072 g/mol
Monoisotopic Mass 409.08964072 g/mol
Topological Polar Surface Area 113 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 624
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