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GSK J5 HCl - ≥98%(HPLC), high purity , CAS No.1797983-32-4

    Grade & Purity:
  • ≥98%(HPLC)
In stock
Item Number
G288263
Grouped product items
SKU Size
Availability
Price Qty
G288263-10mg
10mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$205.90
G288263-50mg
50mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$846.90

Inactive isomer ofGSK J4; cell permeable

Basic Description

Synonyms N-[2-(3-Pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]-β-alanine ethyl ester hydrochloride
Specifications & Purity ≥98%(HPLC)
Biochemical and Physiological Mechanisms Inactive isomer ofGSK J4; also cell permeable ester derivative of the inactive control,GSK J2.Active Analogalso available.
Storage Temp Room temperature
Shipped In Normal

Names and Identifiers

IUPAC Name ethyl 3-[[2-pyridin-3-yl-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-yl]amino]propanoate;hydrochloride
INCHI InChI=1S/C24H27N5O2.ClH/c1-2-31-23(30)9-13-26-21-16-22(28-24(27-21)20-8-5-12-25-17-20)29-14-10-18-6-3-4-7-19(18)11-15-29;/h3-8,12,16-17H,2,9-11,13-15H2,1H3,(H,26,27,28);1H
InChIKey QQHQMHJAOKADED-UHFFFAOYSA-N
Smiles CCOC(=O)CCNC1=CC(=NC(=N1)C2=CN=CC=C2)N3CCC4=CC=CC=C4CC3.Cl
PubChem CID 126456082
Molecular Weight 453.97

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Solubility Solvent:DMSO, Max Conc. mg/mL: 22.7, Max Conc. mM: 50
Molecular Weight 454.000 g/mol
XLogP3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 8
Exact Mass 453.193 Da
Monoisotopic Mass 453.193 Da
Topological Polar Surface Area 80.200 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 546.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 2

Solution Calculators

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