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

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

CAS No.:
883544-72-7
Catalog Number:
AG00GUCS
Molecular Formula:
C11H13N3O2
Molecular Weight:
219.2398
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Product Description
Catalog Number:
AG00GUCS
Chemical Name:
1-isopropyl-6-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
CAS Number:
883544-72-7
Molecular Formula:
C11H13N3O2
Molecular Weight:
219.2398
MDL Number:
MFCD06805329
IUPAC Name:
6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxylic acid
InChI:
InChI=1S/C11H13N3O2/c1-6(2)14-10-9(5-12-14)8(11(15)16)4-7(3)13-10/h4-6H,1-3H3,(H,15,16)
InChI Key:
FZTBEHSMFGKXNA-UHFFFAOYSA-N
SMILES:
Cc1cc(C(=O)O)c2c(n1)n(nc2)C(C)C
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.101g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.244g/mol
Monoisotopic Mass:
219.101g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties