Name: Name:1-benzyl-3-methyl-4-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
Brand: Angene
SKU: AG01B1S1
Rating: 90 (10 reviews)

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

CAS No.:

941120-75-8

Catalog Number:

AG01B1S1

Molecular Formula:

C21H17N3O2

Molecular Weight:

343.3786

Catalog Number:

AG01B1S1

Chemical Name:

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

CAS Number:

941120-75-8

Molecular Formula:

C21H17N3O2

Molecular Weight:

343.3786

MDL Number:

MFCD09394731

IUPAC Name:

1-benzyl-3-methyl-4-phenylpyrazolo[3,4-b]pyridine-6-carboxylic acid

InChI:

InChI=1S/C21H17N3O2/c1-14-19-17(16-10-6-3-7-11-16)12-18(21(25)26)22-20(19)24(23-14)13-15-8-4-2-5-9-15/h2-12H,13H2,1H3,(H,25,26)

InChI Key:

MVQQNZKQWJFBKP-UHFFFAOYSA-N

SMILES:

OC(=O)c1cc(c2ccccc2)c2c(n1)n(Cc1ccccc1)nc2C

Complexity:

488

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

343.132g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

343.386g/mol

Monoisotopic Mass:

343.132g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3