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91759-66-9

91759-66-9 structural image
Product Name: MFCD01067378
Formula: C15H15N3O2S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 38.1 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 301.4 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 301.08849790 g/mol
Monoisotopic Mass 301.08849790 g/mol
Topological Polar Surface Area 94.5 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 351
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