ethyl 1-isopropyl-6-(((trifluoromethyl)sulfonyl)oxy)-1H-pyrazolo[3,4-b]pyridine-4-carboxylate


Chemical Name: ethyl 1-isopropyl-6-(((trifluoromethyl)sulfonyl)oxy)-1H-pyrazolo[3,4-b]pyridine-4-carboxylate
CAS Number: 1396779-52-4
Product Number: AG019F08(AG019F08)
Synonyms:
MDL No:
Molecular Formula: C13H14F3N3O5S
Molecular Weight: 381.3276

Identification/Properties


Computed Properties
Molecular Weight:
381.326g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
6
Exact Mass:
381.061g/mol
Monoisotopic Mass:
381.061g/mol
Topological Polar Surface Area:
109A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
593
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

Safety Information


NMR Spectrum


Other Analytical Data


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