Name: Name:4-chloro-1-(3,5-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Brand: Angene
SKU: AG019O68
Rating: 90 (10 reviews)

4-chloro-1-(3,5-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidine

CAS No.:

885524-15-2

Catalog Number:

AG019O68

Molecular Formula:

C13H11ClN4

Molecular Weight:

258.7062

Catalog Number:

AG019O68

Chemical Name:

4-chloro-1-(3,5-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidine

CAS Number:

885524-15-2

Molecular Formula:

C13H11ClN4

Molecular Weight:

258.7062

MDL Number:

MFCD06660833

IUPAC Name:

4-chloro-1-(3,5-dimethylphenyl)pyrazolo[3,4-d]pyrimidine

InChI:

InChI=1S/C13H11ClN4/c1-8-3-9(2)5-10(4-8)18-13-11(6-17-18)12(14)15-7-16-13/h3-7H,1-2H3

InChI Key:

IFYKTCBGIXRDLX-UHFFFAOYSA-N

SMILES:

Cc1cc(C)cc(c1)n1ncc2c1ncnc2Cl

Complexity:

291

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

258.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

258.709g/mol

Monoisotopic Mass:

258.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5