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478258-67-2

478258-67-2 structural image
Product Name: 6-CHLORO-N-METHYL-2-(METHYLSULFANYL)-4-PYRIMIDINAMINE
Formula: C6H8ClN3S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >28.4 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 189.67 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 189.0127461 g/mol
Monoisotopic Mass 189.0127461 g/mol
Topological Polar Surface Area 63.1 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 124
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