SR 8278 - Moligand™, ≥98% , Antagonist of Rev-Erb-α, CAS No.1254944-66-5, Antagonist of Rev-Erb-α

CAS: 1254944-66-5 Cat. No.: S132222 Peso molecular: 361.48 PubChem CID: 53393127
Disponible para pedir
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
Synonyms
ethyl2-(5-methylsulfanylthiophene-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate | 1254944-66-5 | Q27088866 | SR8278, >=98%, semisolid | AKOS024458171 | GTPL2904 | SCHEMBL20488638 | 1,2,3,4-Tetrahydro-2-[[5-(methylthio)-2-thienyl]carbonyl]-3-isoqui
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5mg
S132222-5mg
3

41,90US$

62,90US$
Guardar 21,00 US$ (33.39%)
25mg
S132222-25mg
2

102,90US$

154,90US$
Guardar 52,00 US$ (33.57%)
50mg
S132222-50mg
2

173,90US$

260,90US$
Guardar 87,00 US$ (33.35%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

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

Specifications

Sinónimos
ethyl2-(5-methylsulfanylthiophene-2-carbonyl)-3, 4-dihydro-1H-isoquinoline-3-carboxylate | 1254944-66-5 | Q27088866 | SR8278, >=98%, semisolid | AKOS024458171 | GTPL2904 | SCHEMBL20488638 | 1, 2, 3, 4-Tetrahydro-2-[[5-(methylthio)-2-thienyl]carbonyl]-3-isoqui
Especificaciones y pureza
Moligand™, ≥98%
Mecanismos bioquímicos y fisiológicos
Rev-Erbαantagonist; inhibits Rev-Erbαtranscriptional repression (EC50= 0.47μM). Blocks activity of Rev-ErbαagonistGSK 4112 in HEK293 cells. Increases expression of glucose-regulating genes, G6PaseandPEPCKin HepG2 cells.
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Grado
Moligand™
Tipo de acción
ANTAGONIST
Mecanismo de acción
Antagonist of Rev-Erb-α
Pureza
≥98%
Nombres e identificadores
Pubchem Sid504771188
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504771188
Sonrisas canónicasCCOC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC=C(S3)SC
IUPAC Nameethyl 2-(5-methylsulfanylthiophene-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate
InChIKeyUIEBLUZPSFAFOC-UHFFFAOYSA-N
INCHI1S/C18H19NO3S2/c1-3-22-18(21)14-10-12-6-4-5-7-13(12)11-19(14)17(20)15-8-9-16(23-2)24-15/h4-9,14H,3,10-11H2,1-2H3
Isómeros SMILES CCOC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC=C(S3)SC
WGK Alemania 3
PubChem CID 53393127
Peso molecular 361.48

Documentation

📋 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
SuperclassOrganic acids and derivatives
ClaseCarboxylic acids and derivatives
SubclassAmino acids, peptides, and analogues
Intermediate Tree Nodes Amino acids and derivatives - Alpha amino acids and derivatives
Direct ParentAlpha amino acid esters
Alternative Parents Tetrahydroisoquinolines  Thiophene carboxamides  2-heteroaryl carboxamides  2,5-disubstituted thiophenes  Alkylarylthioethers  Benzenoids  Tertiary carboxylic acid amides  Heteroaromatic compounds  Carboxylic acid esters  Sulfenyl compounds  Azacyclic compounds  Monocarboxylic acids and derivatives  Organonitrogen compounds  Organic oxides  Carbonyl compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Alpha-amino acid ester - Tetrahydroisoquinoline - 2-heteroaryl carboxamide - Aryl thioether - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - 2,5-disubstituted thiophene - Alkylarylthioether - Benzenoid - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Carboxylic acid ester - Carboxamide group - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
NR1D1 Tchem Nuclear receptor subfamily 1 group D member 1 (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ABL1 Tclin Tyrosine-protein kinase ABL (18331 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GSK3B Tclin Glycogen synthase kinase-3 beta (11785 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CSNK1D Tchem Casein kinase I delta (4546 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CDK2 Tchem Cyclin-dependent kinase 2 (9050 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AURKA Tchem Serine/threonine-protein kinase Aurora-A (10240 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
U2OS (164939 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BRD4 Tchem Bromodomain-containing protein 4 (13122 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NR1D1 Tchem Nuclear receptor subfamily 1 group D member 1 (332 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TRIM24 Tchem Transcription intermediary factor 1-alpha (2087 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BRPF1 Tchem Peregrin (2217 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Mapk1 MAP kinase ERK2 (650 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Fgfr3 Fibroblast growth factor receptor 3 (21 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
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.

3 results found

Lot NumberCertificate TypeFechaArticulo
G2201437Certificate of AnalysisJan 20, 2026 S132222
G2201438Certificate of AnalysisJan 20, 2026 S132222
G2201512Certificate of AnalysisJan 20, 2026 S132222
Propiedades químicas y físicas
SolubilidadSolvent:DMSO, Max Conc. mg/mL: 36.15, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 18.07, Max Conc. mM: 50
Peso molecular361.500 g/mol
XLogP34.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass361.081 Da
Monoisotopic Mass361.081 Da
Topological Polar Surface Area100.000 Ų
Heavy Atom Count24
Formal Charge0
Complexity473.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
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