MC1568 - Moligand™, ≥97%(HPLC) , CAS No.852475-26-4

CAS: 852475-26-4 Cat. No.: M127417 Peso molecular: 314.31 Número EC: 685-051-2
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. ≥97%(HPLC)
Synonyms
3-(4-(3-(3-fluorophenyl)-3-oxoprop-1-enyl)-1-methyl-1H-pyrrol-2-yl)-N-hydroxyacrylamide | CHEBI:95072 | (2E)-3-[4-[(1E)-3-(3-Fluorophenyl)-3-oxo-1-propen-1-yl]-1-methyl-1H-pyrrol-2-yl]-N-hydroxy-2-propenamide | BDBM50166164 | 3-[5-(3-(3-Fluorophenyl)-3-ox
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5mg
M127417-5mg
2
46,90US$
10mg
M127417-10mg
2
64,90US$
25mg
M127417-25mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
146,90US$
50mg
M127417-50mg
2
234,90US$
100mg
M127417-100mg
1
391,90US$
250mg
M127417-250mg
2
823,90US$
Enter a quantity for the sizes you want to add.
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Why this grade

Moligand™, ≥97%(HPLC) Moligand™ 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.

Descripción general

MC1568

Specifications

Sinónimos
3-(4-(3-(3-fluorophenyl)-3-oxoprop-1-enyl)-1-methyl-1H-pyrrol-2-yl)-N-hydroxyacrylamide | CHEBI:95072 | (2E)-3-[4-[(1E)-3-(3-Fluorophenyl)-3-oxo-1-propen-1-yl]-1-methyl-1H-pyrrol-2-yl]-N-hydroxy-2-propenamide | BDBM50166164 | 3-[5-(3-(3-Fluorophenyl)-3-ox
Especificaciones y pureza
Moligand™, ≥97%(HPLC)
Mecanismos bioquímicos y fisiológicos
Selective inhibitor of class IIa histone deacetylases (HDACs). Exhibits tissue-selective inhibition between members of class II deacetylasesin vivo; inhibits HDAC4 and HDAC5 in skeletal muscle and the heart without affecting HDAC3 activity. Arrests myogen
Condiciones de almacenamiento de almacenamiento
Store at -20°C
Enviado en
Ice chest + Ice pads
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Grado
Moligand™
Tipo de acción
INHIBITOR
Pureza
≥97%(HPLC)
Nombres e identificadores
Pubchem Sid504766360
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504766360
Sonrisas canónicasCN1C=C(C=C1C=CC(=O)NO)C=CC(=O)C2=CC(=CC=C2)F
IUPAC Name(E)-3-[4-[(E)-3-(3-fluorophenyl)-3-oxoprop-1-enyl]-1-methylpyrrol-2-yl]-N-hydroxyprop-2-enamide
InChIKeyQRDAPCMJAOQZSU-KQQUZDAGSA-N
INCHI1S/C17H15FN2O3/c1-20-11-12(9-15(20)6-8-17(22)19-23)5-7-16(21)13-3-2-4-14(18)10-13/h2-11,23H,1H3,(H,19,22)/b7-5+,8-6+
Isómeros SMILES CN1C=C(C=C1/C=C/C(=O)NO)/C=C/C(=O)C2=CC(=CC=C2)F
WGK Alemania 3
CAS alternativo 852475-26-4
Peso molecular 314.31
Reaxy-Rn 35762245
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=35762245&ln=

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
SuperclassBenzenoids
ClaseBenzene and substituted derivatives
SubclassBenzoyl derivatives
Intermediate Tree Nodes Not available
Direct ParentBenzoyl derivatives
Alternative Parents Aryl ketones  Fluorobenzenes  N-methylpyrroles  Aryl fluorides  Heteroaromatic compounds  Enones  Acryloyl compounds  Hydroxamic acids  Azacyclic compounds  Organonitrogen compounds  Organofluorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Benzoyl - Aryl ketone - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Substituted pyrrole - N-methylpyrrole - Acryloyl-group - Heteroaromatic compound - Enone - Alpha,beta-unsaturated ketone - Pyrrole - Hydroxamic acid - Ketone - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
HDAC4 Tclin Histone deacetylase 4 (2328 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Hdac1 Histone deacetylase 1 (93 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
hda106 Histone deacetylase HD2 (351 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
hd1b Histone deacetylase HD1B (86 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.

11 results found

Lot NumberCertificate TypeFechaArticulo
H2421016Certificate of AnalysisJun 09, 2026 M127417
L2215694Certificate of AnalysisJun 09, 2026 M127417
L2215697Certificate of AnalysisJun 09, 2026 M127417
L2215743Certificate of AnalysisJun 09, 2026 M127417
L2215821Certificate of AnalysisJun 09, 2026 M127417
L2215822Certificate of AnalysisJun 09, 2026 M127417
K2124280Certificate of AnalysisSep 19, 2023 M127417
K2124281Certificate of AnalysisSep 19, 2023 M127417
K2124282Certificate of AnalysisSep 19, 2023 M127417
K2124299Certificate of AnalysisSep 19, 2023 M127417
L2215690Certificate of AnalysisJul 27, 2022 M127417

Show more ⌵

Propiedades químicas y físicas
SolubilidadSolvent:DMSO, Max Conc. mg/mL: 31.43, Max Conc. mM: 100
Peso molecular314.310 g/mol
XLogP31.800
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass314.107 Da
Monoisotopic Mass314.107 Da
Topological Polar Surface Area71.300 Ų
Heavy Atom Count23
Formal Charge0
Complexity492.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds2
Covalently-Bonded Unit Count1
Calculadoras de soluciones
Reseñas

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