CAS 1928-76-3 | 9H-Purine, 6-chloro-9-(phenylmethyl)- | CAS Number 1928-76-3

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Carboxes > 1928-76-3

1928-76-3 | 9H-Purine, 6-chloro-9-(phenylmethyl)-

CAS No: 1928-76-3 Catalog No: AG002GBS MDL No:MFCD00127805

Product Description

Catalog Number:

AG002GBS

Chemical Name:

9H-Purine, 6-chloro-9-(phenylmethyl)-

CAS Number:

1928-76-3

Molecular Formula:

C12H9ClN4

Molecular Weight:

244.6797

MDL Number:

MFCD00127805

IUPAC Name:

9-benzyl-6-chloropurine

InChI:

InChI=1S/C12H9ClN4/c13-11-10-12(15-7-14-11)17(8-16-10)6-9-4-2-1-3-5-9/h1-5,7-8H,6H2

InChI Key:

NKEFCVAMNJICJZ-UHFFFAOYSA-N

SMILES:

Clc1ncnc2c1ncn2Cc1ccccc1

NSC Number:

25716

Properties

Complexity:

257

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

244.052g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

244.682g/mol

Monoisotopic Mass:

244.052g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Synthesis and biological testing of purine derivatives as potential ATP-competitive kinase inhibitors.	Journal of medicinal chemistry 20050210
Ferrocene-modified purines as potential electrochemical markers: synthesis, crystal structures, electrochemistry and cytostatic activity of (ferrocenylethynyl)- and (ferrocenylethyl)purines.	Chemistry (Weinheim an der Bergstrasse, Germany) 20040419