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439108-94-8

439108-94-8 structural image
Product Name: 3-BROMO-2,5-DIMETHYL-7,8-DIHYDRO-6H-CYCLOPENTA[E]PYRAZOLO[1,5-A]PYRIMIDINE
Formula: C11H12BrN3
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 20.1 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 266.14 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 265.02146 g/mol
Monoisotopic Mass 265.02146 g/mol
Topological Polar Surface Area 30.2 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 260
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