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685109-09-5

685109-09-5 structural image
Product Name: N-ALLYL-N'-(1H-INDAZOL-4-YL)THIOUREA
Formula: C11H12N4S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 34.6 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 232.31 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 232.07826757 g/mol
Monoisotopic Mass 232.07826757 g/mol
Topological Polar Surface Area 84.8 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 269
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