Home Carboxys 1-methyl-5-oxo-1H,4H,5H-pyrazolo[4,3-b]pyridine-6-carboxylic acid

1-methyl-5-oxo-1H,4H,5H-pyrazolo[4,3-b]pyridine-6-carboxylic acid

CAS No.:
2138005-55-5
Catalog Number:
AG01EKX4
Molecular Formula:
C8H7N3O3
Molecular Weight:
193.1595
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Product Description
Catalog Number:
AG01EKX4
Chemical Name:
1-methyl-5-oxo-1H,4H,5H-pyrazolo[4,3-b]pyridine-6-carboxylic acid
CAS Number:
2138005-55-5
Molecular Formula:
C8H7N3O3
Molecular Weight:
193.1595
MDL Number:
MFCD31601591
IUPAC Name:
1-methyl-5-oxo-6H-pyrazolo[4,3-b]pyridine-6-carboxylic acid
InChI:
InChI=1S/C8H7N3O3/c1-11-6-2-4(8(13)14)7(12)10-5(6)3-9-11/h2-4H,1H3,(H,13,14)
InChI Key:
GZLLMYXUEIMBNK-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c([nH]c1=O)cnn2C
Properties
Complexity:
408  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.049g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.162g/mol
Monoisotopic Mass:
193.049g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties