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5459-10-9

5459-10-9 structural image
Product Name: 3-[(3-AMINO-3-OXOPROPYL)THIO]PROPANAMIDE
Formula: C6H12N2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 176.24 g/mol
XLogP3 -1.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 176.06194880 g/mol
Monoisotopic Mass 176.06194880 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 134
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