Name: Name:3-bromo-1-methyl-1H-pyrazolo[4,3-d]pyrimidine-5,7-diol
Brand: Angene
SKU: AG01ELHI
Rating: 90 (10 reviews)

3-bromo-1-methyl-1H-pyrazolo[4,3-d]pyrimidine-5,7-diol

CAS No.:

1033444-07-3

Catalog Number:

AG01ELHI

Molecular Formula:

C6H5BrN4O2

Molecular Weight:

245.0335

Catalog Number:

AG01ELHI

Chemical Name:

3-bromo-1-methyl-1H-pyrazolo[4,3-d]pyrimidine-5,7-diol

CAS Number:

1033444-07-3

Molecular Formula:

C6H5BrN4O2

Molecular Weight:

245.0335

MDL Number:

MFCD31617113

IUPAC Name:

3-bromo-1-methyl-4H-pyrazolo[4,3-d]pyrimidine-5,7-dione

InChI:

InChI=1S/C6H5BrN4O2/c1-11-3-2(4(7)10-11)8-6(13)9-5(3)12/h1H3,(H2,8,9,12,13)

InChI Key:

CCJBQKRNGHJHBD-UHFFFAOYSA-N

SMILES:

Oc1nc(O)c2c(n1)c(Br)nn2C

Complexity:

271

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.96g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

245.036g/mol

Monoisotopic Mass:

243.96g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.1