JMS-053 , CAS No.1954650-11-3

CAS: 1954650-11-3 Cat. No.: J647094 Formula: C13H8N2O2S Peso molecolare: 256.28
Disponibile su ordine
Synonyms
1954650-11-3 | 7-imino-2-phenyl-4H,5H,6H,7H-thieno[3,2-c]pyridine-4,6-dione | HY-135457 | Thieno[3,2-c]pyridine-4,6(5H,7H)-dione, 7-imino-2-phenyl- | PD128069 | 7-imino-2-phenylthieno[3,2-c]pyridine-4,6-dione | compound 13 [PMID: 33766767] | NSC804570 | N
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
Size
Germania (EU)
USA*
Price
Qty
1mg
J647094-1mg
Su ordinazione · 8–12 settimane
313,17€
5mg
J647094-5mg
Su ordinazione · 8–12 settimane
868,52€
10mg
J647094-10mg
Su ordinazione · 8–12 settimane
1.475,94€
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Panoramica

JMS-053 is a potent, selective and reversible PTP4A inhibitor, with IC 50 s of 29.1 nM, 48.0 nM, 34.7 nM, 92.6 nM, and 207.6 nM for PTP4A1 , PTP4A2 , PTP4A3 , CDC25B , and DUSP3 , respectively. JMS-053 can inhibit cancer cell migration and spheroid growth in vitro, attenuate in vivo ovarian tumor growth

Form:Solid

IC50& Target:IC50: 29.1 nM (PTP4A1), 48.0 nM (PTP4A2), 34.7 nM (PTP4A3), 92.6 nM (CDC25B), 207.6 nM (DUSP3)

Specifications

Sinonimi
1954650-11-3 | 7-imino-2-phenyl-4H,5H,6H,7H-thieno[3,2-c]pyridine-4,6-dione | HY-135457 | Thieno[3,2-c]pyridine-4,6(5H,7H)-dione, 7-imino-2-phenyl- | PD128069 | 7-imino-2-phenylthieno[3,2-c]pyridine-4,6-dione | compound 13 [PMID: 33766767] | NSC804570 | N
Meccanismi biochimici e fisiologici
JMS-053 is a potent, selective and reversible PTP4A inhibitor, with IC 50 s of 29.1 nM, 48.0 nM, 34.7 nM, 92.6 nM, and 207.6 nM for PTP4A1 , PTP4A2 , PTP4A3 , CDC25B , and DUSP3 , respectively. JMS-053 can inhibit cancer cell migration and spheroid growth
Condizioni di conservazione di stoccaggio
Store at -20°C
Spedito in
Ice chest + Ice pads
Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.
Nomi e identificatori
Sorrisi canoniciC1=CC=C(C=C1)C2=CC3=C(S2)C(=N)C(=O)NC3=O
IUPAC Name7-imino-2-phenylthieno[3,2-c]pyridine-4,6-dione
InChIKeyCQHAROORCYWRRH-UHFFFAOYSA-N
INCHI1S/C13H8N2O2S/c14-10-11-8(12(16)15-13(10)17)6-9(18-11)7-4-2-1-3-5-7/h1-6,14H,(H,15,16,17)
Isomeri SMILES C1=CC=C(C=C1)C2=CC3=C(S2)C(=N)C(=O)NC3=O
CAS alternativo 1954650-11-3
Termini MeSH 7-imino-2-phenylthieno(3,2-c)pyridine-4,6(5H,7H)-dione;JMS-053
Peso molecolare 256.28

Documentazione

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClasseThienopyridines
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentThienopyridines
Alternative Parents 2,3,5-trisubstituted thiophenes  Pyridines and derivatives  Benzene and substituted derivatives  N-unsubstituted carboxylic acid imides  Heteroaromatic compounds  Dicarboximides  Ketimines  Azacyclic compounds  Organopnictogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Thienopyridine - 2,3,5-trisubstituted thiophene - Benzenoid - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Carboxylic acid imide, n-unsubstituted - Dicarboximide - Carboxylic acid imide - Ketimine - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Imine - Carbonyl group - Aromatic heteropolycyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as thienopyridines. These are heterocyclic compounds containing a thiophene ring fused to a pyridine ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
External Descriptors Not available
Struttura 3D
Modello di struttura chimica interattiva





Obiettivi associati (umani)
PTP4A2 Tchem Protein tyrosine phosphatase type IVA 2 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
PTP4A3 Tchem Protein tyrosine phosphatase type IVA 3 (3 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
PTP4A1 Tchem Protein tyrosine phosphatase type IVA 1 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
MAPK14 Tchem MAP kinase p38 alpha (12866 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PTPN11 Tchem Protein-tyrosine phosphatase 2C (2297 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PTPRC Tchem Leukocyte common antigen (2317 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDA-MB-231 (73002 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PTP4A3 Tchem Protein-tyrosine phosphatase 4A3 (173 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PTP4A1 Tchem Protein tyrosine phosphatase type IVA 1 (47 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PTP4A2 Tchem Protein tyrosine phosphatase type IVA 2 (36 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PTPN5 Tchem Tyrosine-protein phosphatase non-receptor type 5 (536 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TXN Tchem Thioredoxin (111 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PTPRO Tbio Receptor-type tyrosine-protein phosphatase O (15 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Obiettivi associati (non umani)
Cdc25b Dual specificity phosphatase Cdc25B (32 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Ptpn1 Protein-tyrosine phosphatase 1B (270 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Meccanismi d'azione
Certificati (CoA, COO, BSE/TSE e tabella di analisi)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Proprietà chimiche e fisiche
Peso molecolare256.279 g/mol
XLogP32.400
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass256.031 Da
Monoisotopic Mass256.031 Da
Topological Polar Surface Area98.300 Ų
Heavy Atom Count18
Formal Charge0
Complexity404.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calcolatori di soluzioni
Recensioni

Recensioni dei clienti

Domande frequenti

How should this product be stored?
Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.
How is this product shipped?
This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 1954650-11-3, the molecular formula is C13H8N2O2S, and the molecular weight is 256.28 g/mol. InChIKey CQHAROORCYWRRH-UHFFFAOYSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.

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