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883469-12-3

883469-12-3 structural image
Product Name: N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]thiophene-2-carboxamide
Formula: C13H12N4OS
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >40.8 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 272.33 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 272.07318219 g/mol
Monoisotopic Mass 272.07318219 g/mol
Topological Polar Surface Area 87.5 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 328
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