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1396964-43-4

1396964-43-4 structural image
Product Name: 2-(1,1-DIOXO-2,3-DIHYDRO-1H-1LAMBDA6-THIOPHEN-3-YLAMINO)-3-METHYL-BUTYRIC ACID
Formula: C9H15NO4S
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COMPUTED DESCRIPTORS

Molecular Weight 233.29 g/mol
XLogP3 -2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 233.07217913 g/mol
Monoisotopic Mass 233.07217913 g/mol
Topological Polar Surface Area 91.8 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 366
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes