Name: Name:4-oxo-3H,4H-pyrido[3,4-d]pyrimidine-6-carboxylic acid
Brand: Angene
SKU: AG01E9M7
Rating: 90 (10 reviews)

4-oxo-3H,4H-pyrido[3,4-d]pyrimidine-6-carboxylic acid

CAS No.:

845639-88-5

Catalog Number:

AG01E9M7

Molecular Formula:

C8H5N3O3

Molecular Weight:

191.1436

Catalog Number:

AG01E9M7

Chemical Name:

4-oxo-3H,4H-pyrido[3,4-d]pyrimidine-6-carboxylic acid

CAS Number:

845639-88-5

Molecular Formula:

C8H5N3O3

Molecular Weight:

191.1436

MDL Number:

MFCD20658902

IUPAC Name:

4-oxo-3H-pyrido[3,4-d]pyrimidine-6-carboxylic acid

InChI:

InChI=1S/C8H5N3O3/c12-7-4-1-5(8(13)14)9-2-6(4)10-3-11-7/h1-3H,(H,13,14)(H,10,11,12)

InChI Key:

QLHOWKLZVNAPAZ-UHFFFAOYSA-N

SMILES:

OC(=O)c1ncc2c(c1)c(=O)[nH]cn2

Complexity:

302

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

191.033g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

191.146g/mol

Monoisotopic Mass:

191.033g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.5