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878465-47-5

878465-47-5 structural image
Product Name: Urea, N-[1-(1-methylethyl)-1H-pyrazol-5-yl]-N'-phenyl-
Formula: C13H16N4O
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 22.1 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 244.29 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 244.13241115 g/mol
Monoisotopic Mass 244.13241115 g/mol
Topological Polar Surface Area 59 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 276
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