Name: Name:3-tert-butyl-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid
Brand: Angene
SKU: AG01A88V
Rating: 90 (10 reviews)

3-tert-butyl-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

CAS No.:

926257-81-0

Catalog Number:

AG01A88V

Molecular Formula:

C12H15N3O2

Molecular Weight:

233.2664

Catalog Number:

AG01A88V

Chemical Name:

3-tert-butyl-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

CAS Number:

926257-81-0

Molecular Formula:

C12H15N3O2

Molecular Weight:

233.2664

MDL Number:

MFCD09045788

IUPAC Name:

3-tert-butyl-1-methylpyrazolo[3,4-b]pyridine-5-carboxylic acid

InChI:

InChI=1S/C12H15N3O2/c1-12(2,3)9-8-5-7(11(16)17)6-13-10(8)15(4)14-9/h5-6H,1-4H3,(H,16,17)

InChI Key:

GQDZSSODSXPNQY-UHFFFAOYSA-N

SMILES:

OC(=O)c1cnc2c(c1)c(nn2C)C(C)(C)C

Complexity:

313

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.116g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.271g/mol

Monoisotopic Mass:

233.116g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1