Name: Name:1-methyl-3-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid
Brand: Angene
SKU: AG01EKMP
Rating: 90 (10 reviews)

1-methyl-3-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

CAS No.:

1779765-25-1

Catalog Number:

AG01EKMP

Molecular Formula:

C9H6F3N3O2

Molecular Weight:

245.1580

Catalog Number:

AG01EKMP

Chemical Name:

1-methyl-3-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

CAS Number:

1779765-25-1

Molecular Formula:

C9H6F3N3O2

Molecular Weight:

245.1580

MDL Number:

MFCD28535536

IUPAC Name:

1-methyl-3-(trifluoromethyl)pyrazolo[3,4-b]pyridine-5-carboxylic acid

InChI:

InChI=1S/C9H6F3N3O2/c1-15-7-5(6(14-15)9(10,11)12)2-4(3-13-7)8(16)17/h2-3H,1H3,(H,16,17)

InChI Key:

LMVMZKHGTGYNOR-UHFFFAOYSA-N

SMILES:

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

Complexity:

323

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

245.041g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

245.161g/mol

Monoisotopic Mass:

245.041g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3