4H-Pyrazolo[3,4-d]pyrimidin-4-one, 3-bromo-1,5-dihydro-


Chemical Name: 4H-Pyrazolo[3,4-d]pyrimidin-4-one, 3-bromo-1,5-dihydro-
CAS Number: 54738-73-7
Product Number: AG00DELN(AGN-PC-0OC3XZ)
Synonyms:
MDL No:
Molecular Formula: C5H3BrN4O
Molecular Weight: 215.0075

Identification/Properties


Computed Properties
Molecular Weight:
215.01g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
213.949g/mol
Monoisotopic Mass:
213.949g/mol
Topological Polar Surface Area:
70.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
219
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

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NMR Spectrum


Other Analytical Data


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