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332867-72-8

332867-72-8 structural image
Product Name: BUTTPARK 101\41-85
Formula: C14H12N4O2S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >45.1 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 300.34 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 300.06809681 g/mol
Monoisotopic Mass 300.06809681 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 365
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