BQCA - ≥98%(HPLC) , CAS No.338747-41-4

CAS: 338747-41-4 Cat. No.: B169694 Peso molecular: 309.32 Número EC: 803-580-0
Disponible para pedir
GRADE & PURITY ≥98%(HPLC)
Synonyms
HY-101858 | 1-(4-methoxybenzyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid | MLS000755157 | HMS2641J10 | 1-(4-Methoxy-benzyl)-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid | 1-(4-methoxybenzyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid | MFCD01315710
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
10mg
B169694-10mg
2
35,90US$
50mg
B169694-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
155,90US$
250mg
B169694-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
771,90US$
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Why this grade

≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads 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.

Descripción general

BQCA a highly selective allosteric modulator of the M1 mAChR.

Specifications

Sinónimos
HY-101858 | 1-(4-methoxybenzyl)-4-oxo-1, 4-dihydro-3-quinolinecarboxylic acid | MLS000755157 | HMS2641J10 | 1-(4-Methoxy-benzyl)-4-oxo-1, 4-dihydro-quinoline-3-carboxylic acid | 1-(4-methoxybenzyl)-4-oxo-1, 4-dihydroquinoline-3-carboxylic acid | MFCD01315710
Especificaciones y pureza
≥98%(HPLC)
Mecanismos bioquímicos y fisiológicos
Muscarinic M1receptor positive allosteric modulator (pKB5.76 - 5.82). Exhibits selectivity for M1over M3and M5receptors. Enhances ACh effects at M1receptors in an IP1- accumulation assay, without affecting ACh binding. Increases markers of neuronal activa
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.
Pureza
≥98%(HPLC)
Nombres e identificadores
Pubchem Sid504760504
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504760504
Sonrisas canónicasCOC1=CC=C(C=C1)CN2C=C(C(=O)C3=CC=CC=C32)C(=O)O
IUPAC Name1-[(4-methoxyphenyl)methyl]-4-oxoquinoline-3-carboxylic acid
InChIKeyBZBBTGCKPRSPGF-UHFFFAOYSA-N
INCHI1S/C18H15NO4/c1-23-13-8-6-12(7-9-13)10-19-11-15(18(21)22)17(20)14-4-2-3-5-16(14)19/h2-9,11H,10H2,1H3,(H,21,22)
Isómeros SMILES COC1=CC=C(C=C1)CN2C=C(C(=O)C3=CC=CC=C32)C(=O)O
WGK Alemania 3
Peso molecular 309.32
Reaxy-Rn 12911382
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=12911382&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
SuperclassOrganoheterocyclic compounds
ClaseQuinolines and derivatives
Subclass1-benzylquinolines
Intermediate Tree Nodes Not available
Direct Parent1-benzylquinolines
Alternative Parents Quinoline carboxylic acids  Hydroquinolones  Hydroquinolines  Pyridinecarboxylic acids  Phenoxy compounds  Anisoles  Methoxybenzenes  Alkyl aryl ethers  Vinylogous amides  Heteroaromatic compounds  Carboxylic acids  Azacyclic compounds  Monocarboxylic acids and derivatives  Organonitrogen compounds  Hydrocarbon derivatives  Organopnictogen compounds  Organic oxides  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 1-benzylquinoline - Quinoline-3-carboxylic acid - Dihydroquinolone - Dihydroquinoline - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Methoxybenzene - Anisole - Phenol ether - Phenoxy compound - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Pyridine - Heteroaromatic compound - Vinylogous amide - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as 1-benzylquinolines. These are organic aromatic compounds containing a quinoline that is substituted at the 1-position by a benzyl group.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
CHRM2 Tclin Muscarinic acetylcholine receptor M2 (10671 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CHRM1 Tclin Muscarinic acetylcholine receptor M1 (12690 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ACHE Tclin Acetylcholinesterase (18204 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CHRM4 Tclin Muscarinic acetylcholine receptor M4 (6041 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CHRM5 Tclin Muscarinic acetylcholine receptor M5 (4677 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CHRM3 Tclin Muscarinic acetylcholine receptor M3 (7750 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AKR1B1 Tclin Aldose reductase (1404 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BCHE Tclin Butyrylcholinesterase (7174 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AKR1A1 Tchem Aldehyde reductase (91 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Canis familiaris (36305 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mus musculus (284745 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Serum (58 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.

1 results found

Lot NumberCertificate TypeFechaArticulo
D2023165Certificate of AnalysisNov 10, 2025 B169694
Propiedades químicas y físicas
SolubilidadSolvent:DMSO, Max Conc. mg/mL: 6.19, Max Conc. mM: 20 with gentle warming
Peso molecular309.300 g/mol
XLogP33.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass309.1 Da
Monoisotopic Mass309.1 Da
Topological Polar Surface Area66.800 Ų
Heavy Atom Count23
Formal Charge0
Complexity493.000
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
Calculadoras de soluciones
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