Name: Name:2-chloro-1-(4-{1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one hydrochloride
Brand: Angene
SKU: AG01AAOI
Rating: 90 (10 reviews)

2-chloro-1-(4-{1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one hydrochloride

CAS No.:

1258651-81-8

Catalog Number:

AG01AAOI

Molecular Formula:

C12H16Cl2N6O

Molecular Weight:

331.2010

Catalog Number:

AG01AAOI

Chemical Name:

2-chloro-1-(4-{1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one hydrochloride

CAS Number:

1258651-81-8

Molecular Formula:

C12H16Cl2N6O

Molecular Weight:

331.2010

MDL Number:

MFCD17480372

IUPAC Name:

2-chloro-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]ethanone;hydrochloride

InChI:

InChI=1S/C12H15ClN6O.ClH/c1-17-11-9(7-16-17)12(15-8-14-11)19-4-2-18(3-5-19)10(20)6-13;/h7-8H,2-6H2,1H3;1H

InChI Key:

YJDADOQWPIHKRL-UHFFFAOYSA-N

SMILES:

ClCC(=O)N1CCN(CC1)c1ncnc2c1cnn2C.Cl

Complexity:

362

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

330.076g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

331.201g/mol

Monoisotopic Mass:

330.076g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: