BAY 87-2243 - ≥98%(HPLC) , CAS No.1227158-85-1

CAS: 1227158-85-1 Cat. No.: B287776 Peso molecular: 525.54
Disponible para pedir
GRADE & PURITY ≥98%(HPLC)
Synonyms
NSC795507 | NSC-795507 | s7309 | EX-A2031 | 5-[1-[[2-(4-cyclopropylpiperazin-1-yl)pyridin-4-yl]methyl]-5-methylpyrazol-3-yl]-3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazole | 1-Cyclopropyl-4-[4-[[5-methyl-3-[3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5mg
B287776-5mg
3
101,90US$
10mg
B287776-10mg
3
175,90US$
25mg
B287776-25mg
2
435,90US$
50mg
B287776-50mg
2
704,90US$
100mg
B287776-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.392,90US$
Enter a quantity for the sizes you want to add.
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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.

Specifications

Sinónimos
NSC795507 | NSC-795507 | s7309 | EX-A2031 | 5-[1-[[2-(4-cyclopropylpiperazin-1-yl)pyridin-4-yl]methyl]-5-methylpyrazol-3-yl]-3-[4-(trifluoromethoxy)phenyl]-1, 2, 4-oxadiazole | 1-Cyclopropyl-4-[4-[[5-methyl-3-[3-[4-(trifluoromethoxy)phenyl]-1, 2, 4-oxadiazol-
Especificaciones y pureza
≥98%(HPLC)
Mecanismos bioquímicos y fisiológicos
Mitochondrial complex I inhibitor. Exhibits no effect on mitochondrial complex III. Induces mitochondrial permeability transition pore (mPTP) opening, stimulates autophagosome formation and mitophagy, and increases ROS levels. Activates necroptotic and fe
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 Sid504771894
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504771894
Sonrisas canónicasCC1=CC(=NN1CC2=CC(=NC=C2)N3CCN(CC3)C4CC4)C5=NC(=NO5)C6=CC=C(C=C6)OC(F)(F)F
IUPAC Name5-[1-[[2-(4-cyclopropylpiperazin-1-yl)pyridin-4-yl]methyl]-5-methylpyrazol-3-yl]-3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazole
InChIKeyCDJNNOJINJAXPV-UHFFFAOYSA-N
INCHI1S/C26H26F3N7O2/c1-17-14-22(25-31-24(33-38-25)19-2-6-21(7-3-19)37-26(27,28)29)32-36(17)16-18-8-9-30-23(15-18)35-12-10-34(11-13-35)20-4-5-20/h2-3,6-9,14-15,20H,4-5,10-13,16H2,1H3
Isómeros SMILES CC1=CC(=NN1CC2=CC(=NC=C2)N3CCN(CC3)C4CC4)C5=NC(=NO5)C6=CC=C(C=C6)OC(F)(F)F
Peso molecular 525.54
Reaxy-Rn 23770506
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=23770506&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
ClaseDiazinanes
SubclassPiperazines
Intermediate Tree Nodes Not available
Direct ParentPyridinylpiperazines
Alternative Parents N-arylpiperazines  Phenyloxadiazoles  Dialkylarylamines  Phenoxy compounds  Phenol ethers  Aminopyridines and derivatives  N-alkylpiperazines  Imidolactams  Heteroaromatic compounds  Pyrazoles  Trihalomethanes  Trialkylamines  Oxacyclic compounds  Azacyclic compounds  Hydrocarbon derivatives  Alkyl fluorides  Organooxygen compounds  Organofluorides  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Pyridinylpiperazine - N-arylpiperazine - Phenyl-1,2,4-oxadiazole - Phenoxy compound - Dialkylarylamine - Phenol ether - N-alkylpiperazine - Aminopyridine - Imidolactam - Benzenoid - Pyridine - Monocyclic benzene moiety - Oxadiazole - Azole - Pyrazole - 1,2,4-oxadiazole - Heteroaromatic compound - Trihalomethane - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Halomethane - Organic oxygen compound - Amine - Alkyl halide - Organic nitrogen compound - Alkyl fluoride - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





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Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GSK3B Tclin Glycogen synthase kinase-3 beta (11785 Activities)
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CSNK1D Tchem Casein kinase I delta (4546 Activities)
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CDK2 Tchem Cyclin-dependent kinase 2 (9050 Activities)
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AURKA Tchem Serine/threonine-protein kinase Aurora-A (10240 Activities)
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Homo sapiens (32628 Activities)
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G-361 (890 Activities)
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SK-MEL-28 (48833 Activities)
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U2OS (164939 Activities)
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BRD4 Tchem Bromodomain-containing protein 4 (13122 Activities)
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TRIM24 Tchem Transcription intermediary factor 1-alpha (2087 Activities)
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BRPF1 Tchem Peregrin (2217 Activities)
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HEK-293T (167025 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
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Fgfr3 Fibroblast growth factor receptor 3 (21 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 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.

6 results found

Lot NumberCertificate TypeFechaArticulo
E2621182Certificate of AnalysisMay 26, 2026 B287776
B2225061Certificate of AnalysisDec 18, 2024 B287776
B2225064Certificate of AnalysisDec 18, 2024 B287776
B2225087Certificate of AnalysisDec 18, 2024 B287776
B2225098Certificate of AnalysisDec 18, 2024 B287776
B2225101Certificate of AnalysisDec 18, 2024 B287776
Propiedades químicas y físicas
SolubilidadSolvent:DMSO, Max Conc. mg/mL: 26.28, Max Conc. mM: 50; Solvent:ethanol, Max Conc. mg/mL: 10.51, Max Conc. mM: 20
Peso molecular525.500 g/mol
XLogP34.700
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Exact Mass525.21 Da
Monoisotopic Mass525.21 Da
Topological Polar Surface Area85.300 Ų
Heavy Atom Count38
Formal Charge0
Complexity774.000
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
Preguntas frecuentes y artículos
Calculadoras de soluciones
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