Name: Name:ethyl 1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
Brand: Angene
SKU: AG01AULR
Rating: 90 (10 reviews)

ethyl 1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

CAS No.:

57411-72-0

Catalog Number:

AG01AULR

Molecular Formula:

C12H15N3O2

Molecular Weight:

233.2664

Catalog Number:

AG01AULR

Chemical Name:

ethyl 1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

CAS Number:

57411-72-0

Molecular Formula:

C12H15N3O2

Molecular Weight:

233.2664

MDL Number:

MFCD11487930

IUPAC Name:

ethyl 1,3,6-trimethylpyrazolo[3,4-b]pyridine-5-carboxylate

InChI:

InChI=1S/C12H15N3O2/c1-5-17-12(16)10-6-9-8(3)14-15(4)11(9)13-7(10)2/h6H,5H2,1-4H3

InChI Key:

CELVKOQNKMGWGA-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cc2c(C)nn(c2nc1C)C

Complexity:

298

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:

57A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9