Name: Name:2-Methyl-7-oxo-4,7-dihydro-[1,2,4]triazolo[1,5-a]-pyrimidine-6-carboxylic acid
Brand: Angene
SKU: AG004TI6
Rating: 90 (10 reviews)

2-Methyl-7-oxo-4,7-dihydro-[1,2,4]triazolo[1,5-a]-pyrimidine-6-carboxylic acid

CAS No.:

842954-97-6

Catalog Number:

AG004TI6

Molecular Formula:

C7H6N4O3

Molecular Weight:

194.1475

Catalog Number:

AG004TI6

Chemical Name:

2-Methyl-7-oxo-4,7-dihydro-[1,2,4]triazolo[1,5-a]-pyrimidine-6-carboxylic acid

CAS Number:

842954-97-6

Molecular Formula:

C7H6N4O3

Molecular Weight:

194.1475

MDL Number:

MFCD00781860

IUPAC Name:

2-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid

InChI:

InChI=1S/C7H6N4O3/c1-3-9-7-8-2-4(6(13)14)5(12)11(7)10-3/h2H,1H3,(H,13,14)(H,8,9,10)

InChI Key:

GRFFCRIIYZSEAF-UHFFFAOYSA-N

SMILES:

Cc1nc2n([nH]1)c(=O)c(cn2)C(=O)O

Complexity:

421

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

194.044g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

194.15g/mol

Monoisotopic Mass:

194.044g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

94.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.6