Name: Name:1-(3-chlorophenyl)-6-methyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one
Brand: Angene
SKU: AG019XG5
Rating: 90 (10 reviews)

1-(3-chlorophenyl)-6-methyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one

CAS No.:

1097095-35-6

Catalog Number:

AG019XG5

Molecular Formula:

C12H9ClN4O

Molecular Weight:

260.6791

Catalog Number:

AG019XG5

Chemical Name:

1-(3-chlorophenyl)-6-methyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one

CAS Number:

1097095-35-6

Molecular Formula:

C12H9ClN4O

Molecular Weight:

260.6791

MDL Number:

MFCD11544235

IUPAC Name:

1-(3-chlorophenyl)-6-methyl-5H-pyrazolo[3,4-d]pyrimidin-4-one

InChI:

InChI=1S/C12H9ClN4O/c1-7-15-11-10(12(18)16-7)6-14-17(11)9-4-2-3-8(13)5-9/h2-6H,1H3,(H,15,16,18)

InChI Key:

FGNFLLALMJCHAE-UHFFFAOYSA-N

SMILES:

Clc1cccc(c1)n1ncc2c1nc(C)[nH]c2=O

Complexity:

386

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

260.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

260.681g/mol

Monoisotopic Mass:

260.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6