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4333-22-6

4333-22-6 structural image
Product Name: PHENYLTHIOHYDANTOIN-NORLEUCINE
Formula: C13H16N2OS
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COMPUTED DESCRIPTORS

Molecular Weight 248.35 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 248.09833431 g/mol
Monoisotopic Mass 248.09833431 g/mol
Topological Polar Surface Area 64.4 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 300
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