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1309670-47-0

1309670-47-0 structural image
Product Name: N-[(E)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide
Formula: C16H13ClN4O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility <0.2 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 328.75 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 328.0727034 g/mol
Monoisotopic Mass 328.0727034 g/mol
Topological Polar Surface Area 83.3 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 448
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes