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PS48 - ≥95%, high purity , CAS No.1180676-32-7

    Grade & Purity:
  • ≥95%
In stock
Item Number
P274933
Grouped product items
SKU Size
Availability
Price Qty
P274933-5mg
5mg
3
$90.90
P274933-25mg
25mg
2
$342.90

Allosteric phosphoinositide-dependent protein kinase-1 (PDK1) agonist

Basic Description

Synonyms 5-(4-Chloro-phenyl)-3-phenyl-pent-2-enoic acid
Specifications & Purity ≥95%
Biochemical and Physiological Mechanisms Allosteric PDK1 activator. Stimulates PI3-kinase and phosphorylates AKT. Binds to the PIF pocket in the small lobe of PDK1. Shows developmental effects in vivo.
Storage Temp Store at 2-8°C,Protected from light,Desiccated
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Note Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.
Product Description

PS48 is a PDK1 (phosphoinositide-dependent protein kinase 1) activator which binds to the HM/PIF binding pocket rather than the ATP-binding site. PS48 is one of only a few truly allosteric compounds targeting a regulatory binding site on a protein kinase catalytic domain that is not adjacent to or overlapping with the ATP-binding site.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Phenylpropanoids and polyketides
Class Linear 1,3-diarylpropanoids
Subclass Not available
Intermediate Tree Nodes Not available
Direct Parent Linear 1,3-diarylpropanoids
Alternative Parents Cinnamic acids  Styrenes  Medium-chain fatty acids  Halogenated fatty acids  Chlorobenzenes  Unsaturated fatty acids  Aryl chlorides  Monocarboxylic acids and derivatives  Carboxylic acids  Organochlorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular Framework Aromatic homomonocyclic compounds
Substituents Linear 1,3-diarylpropanoid - Cinnamic acid - Cinnamic acid or derivatives - Medium-chain fatty acid - Styrene - Chlorobenzene - Halobenzene - Halogenated fatty acid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Fatty acid - Benzenoid - Unsaturated fatty acid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organochloride - Organohalogen compound - Organic oxide - Aromatic homomonocyclic compound
Description This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.
External Descriptors Not available

Product Properties

pKa pKₐ: 4.55 (Predicted)

Associated Targets(Human)

PRKCZ Tchem Protein kinase C zeta (2414 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
PDPK1 Tchem 3-phosphoinositide dependent protein kinase-1 (3758 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
PKN2 Tchem Protein kinase N2 (1991 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
AKT1 Tchem Serine/threonine-protein kinase AKT (9192 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
PDK1 Tchem Pyruvate dehydrogenase kinase isoform 1 (2021 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SGK1 Tchem Serine/threonine-protein kinase Sgk1 (2343 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
RPS6KB1 Tchem Ribosomal protein S6 kinase 1 (4456 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name (Z)-5-(4-chlorophenyl)-3-phenylpent-2-enoic acid
INCHI InChI=1S/C17H15ClO2/c18-16-10-7-13(8-11-16)6-9-15(12-17(19)20)14-4-2-1-3-5-14/h1-5,7-8,10-12H,6,9H2,(H,19,20)/b15-12-
InChIKey LLJYFDRQFPQGNY-QINSGFPZSA-N
Smiles C1=CC=C(C=C1)C(=CC(=O)O)CCC2=CC=C(C=C2)Cl
Isomeric SMILES C1=CC=C(C=C1)/C(=C\C(=O)O)/CCC2=CC=C(C=C2)Cl
WGK Germany 3
PubChem CID 44141940
Molecular Weight 286.76

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

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

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot Number Certificate Type Date Item
E2430296 Certificate of Analysis May 06, 2024 P274933
E2430298 Certificate of Analysis May 06, 2024 P274933
E2430297 Certificate of Analysis May 06, 2024 P274933
E2430320 Certificate of Analysis May 06, 2024 P274933

Chemical and Physical Properties

Solubility Soluble in DMSO to 100 mM and in ethanol to 50 mM
Sensitivity light sensitive
Refractive Index n20D1.61 (Predicted)
Boil Point(°C) ~444.1° C at 760 mmHg (Predicted)
Molecular Weight 286.800 g/mol
XLogP3 5.000
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 5
Exact Mass 286.076 Da
Monoisotopic Mass 286.076 Da
Topological Polar Surface Area 37.300 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 337.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 1
Covalently-Bonded Unit Count 1

Citations of This Product

1. Xiao Wang, Zhen Li, Xiaojing Wu, Bingjie Liu, Tian Tian, Yi Ding, Haibo Zhang, Yuanli Li, Ye Liu, Chunai Dai.  (2024)  Self-Floating Polydopamine/Polystyrene Composite Porous Structure via a NaCl Template Method for Solar-Driven Interfacial Water Evaporation.  Polymers,  16  (15): (2231). 

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