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163927-31-9

163927-31-9 structural image
Product Name: (R)-(-)-DBD-PY-NCS
Formula: C13H15N5O3S2
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COMPUTED DESCRIPTORS

Molecular Weight 353.4 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 4
Exact Mass 353.06163170 g/mol
Monoisotopic Mass 353.06163170 g/mol
Topological Polar Surface Area 132 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 587
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes