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TCS PIM-1 1 - ≥98%(HPLC), high purity , CAS No.491871-58-0

COA

Grade & Purity:

≥98%(HPLC)

Cas Number: 491871-58-0
Molecular Weight: 367.2
PubChem CID: 1235170
PubChem SID: 504760423

In stock

Item Number

T288715

Grouped product items
SKU	Size	Availability	Price
T288715-5mg	5mg	2	$76.90
T288715-10mg	10mg	3	$127.90
T288715-25mg	25mg	2	$288.90
T288715-50mg	50mg	3	$557.90
T288715-100mg	100mg	2	$1,004.90

Selective, ATP-competitive Pim-1 kinase inhibitor

View related series

JAK/STAT Signaling (507) Pim (31)

Basic Description

Synonyms	SC 204330 \| 3-Cyano-4-phenyl-6-(3-bromo-6-hydroxy)phenyl-2(1H)-pyridone \| 6-(5-bromo-2-hydroxyphenyl)-2-oxo-4-phenyl-1,2-dihydropyridine-3-carbonitrile
Specifications & Purity	≥98%(HPLC)
Biochemical and Physiological Mechanisms	ATP-competitive Pim-1 kinase inhibitor that displays selectivity over Pim-2 and MEK1/2 (IC50values are 50, > 20000 and > 20000 nM for Pim-1, Pim-2 and MEK1/2 respectively).
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Phenylpyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Phenylpyridines
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpyridines
Alternative Parents	P-bromophenols 3-pyridinecarbonitriles Pyridinones 1-hydroxy-2-unsubstituted benzenoids Bromobenzenes Dihydropyridines Aryl bromides Heteroaromatic compounds Lactams Nitriles Azacyclic compounds Organopnictogen compounds Organic oxides Organobromides Organooxygen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	2-phenylpyridine - 4-phenylpyridine - 4-halophenol - 4-bromophenol - 3-pyridinecarbonitrile - Bromobenzene - Dihydropyridine - Halobenzene - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Pyridinone - Monocyclic benzene moiety - Aryl bromide - Aryl halide - Benzenoid - Hydropyridine - Heteroaromatic compound - Lactam - Azacycle - Nitrile - Carbonitrile - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
External Descriptors	nitrile - ring assembly - pyridone - bromophenol
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

PIM1 Tchem Serine/threonine-protein kinase PIM1 (9629 Activities)

Discover Target: PIM1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

MAP2K2 Tclin Dual specificity mitogen-activated protein kinase kinase 2 (1262 Activities)

Discover Target: MAP2K2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

MAP2K1 Tclin Dual specificity mitogen-activated protein kinase kinase 1 (4127 Activities)

Discover Target: MAP2K1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PIM2 Tchem Serine/threonine-protein kinase PIM2 (5873 Activities)

Discover Target: PIM2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

BIRC5 Tchem Baculoviral IAP repeat-containing protein 5 (144 Activities)

Discover Target: BIRC5

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

Pubchem Sid	504760423
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504760423
IUPAC Name	6-(5-bromo-2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile
INCHI	InChI=1S/C18H11BrN2O2/c19-12-6-7-17(22)14(8-12)16-9-13(11-4-2-1-3-5-11)15(10-20)18(23)21-16/h1-9,22H,(H,21,23)
InChIKey	SVSYJTYGPLVUOZ-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)C2=C(C(=O)NC(=C2)C3=C(C=CC(=C3)Br)O)C#N
Isomeric SMILES	C1=CC=C(C=C1)C2=C(C(=O)NC(=C2)C3=C(C=CC(=C3)Br)O)C#N
PubChem CID	1235170
Molecular Weight	367.2

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.

6 results found

Lot Number	Certificate Type	Date	Item
C2304082	Certificate of Analysis	Oct 20, 2022	T288715
C2304090	Certificate of Analysis	Oct 20, 2022	T288715
C2304078	Certificate of Analysis	Oct 20, 2022	T288715
C2304079	Certificate of Analysis	Oct 20, 2022	T288715
C2304084	Certificate of Analysis	Oct 20, 2022	T288715
C2512055	Certificate of Analysis	Oct 20, 2022	T288715

Chemical and Physical Properties

Solubility	Solvent:DMSO, Max Conc. mg/mL: 36.72, Max Conc. mM: 100
Molecular Weight	367.200 g/mol
XLogP3	3.300
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	366 Da
Monoisotopic Mass	366 Da
Topological Polar Surface Area	73.100 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	595.000
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	1

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