Name: Name:5-bromo-2-(propan-2-ylamino)pyrimidine-4-carboxylic acid
Brand: Angene
SKU: AG01DWW4
Rating: 90 (10 reviews)

5-bromo-2-(propan-2-ylamino)pyrimidine-4-carboxylic acid

CAS No.:

937640-08-9

Catalog Number:

AG01DWW4

Molecular Formula:

C8H10BrN3O2

Molecular Weight:

260.0879

Catalog Number:

AG01DWW4

Chemical Name:

5-bromo-2-(propan-2-ylamino)pyrimidine-4-carboxylic acid

CAS Number:

937640-08-9

Molecular Formula:

C8H10BrN3O2

Molecular Weight:

260.0879

MDL Number:

MFCD09837244

IUPAC Name:

5-bromo-2-(propan-2-ylamino)pyrimidine-4-carboxylic acid

InChI:

InChI=1S/C8H10BrN3O2/c1-4(2)11-8-10-3-5(9)6(12-8)7(13)14/h3-4H,1-2H3,(H,13,14)(H,10,11,12)

InChI Key:

KGIIUYSPRJHUJG-UHFFFAOYSA-N

SMILES:

CC(Nc1ncc(c(n1)C(=O)O)Br)C

Complexity:

213

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

258.996g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

260.091g/mol

Monoisotopic Mass:

258.996g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9