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393835-01-3

393835-01-3 structural image
Product Name: 2-Furancarboxamide, 5-bromo-N-[4-[[2-(3-pyridinyl)-1-piperidinyl]sulfonyl]phenyl]-
Formula: C21H20BrN3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 490.4 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 489.03579 g/mol
Monoisotopic Mass 489.03579 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 693
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes