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287922-40-1

287922-40-1 structural image
Product Name: 4-AMINO-2-(4-METHYLPHENYL)-6-(METHYLTHIO)PYRIMIDINE-5-CARBONITRILE
Formula: C13H12N4S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility <0.1 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 256.33 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 256.07826757 g/mol
Monoisotopic Mass 256.07826757 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 318
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