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BI-4464 - ≥97% , CAS No.1227948-02-8

CAS: 1227948-02-8 Cat. No.: B413513 Fórmula: C28H28F3N5O4 Peso molecular: 555.55
COA
BI-4464 - ≥97% CAS No(1227948-02-8) by Aladdin Scientific
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
3-Methoxy-N-(1-methylpiperidin-4-yl)-4-((4-((3-oxo-2,3-dihydro-1H-inden-4-yl)oxy)-5-(trifluoromethyl)pyrimidin-2-yl)amino)benzamide
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
Size
USA
Alemania (EU)*
Price
Qty
1mg
B413513-1mg
3 Disponible
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26,90US$

40,90US$
Guardar 14,00 US$ (34.23%)
5mg
B413513-5mg
1 Disponible
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61,90US$

92,90US$
Guardar 31,00 US$ (33.37%)
10mg
B413513-10mg
1 Disponible
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90,90US$

136,90US$
Guardar 46,00 US$ (33.60%)
25mg
B413513-25mg
1 Disponible
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154,90US$

232,90US$
Guardar 78,00 US$ (33.49%)
50mg
B413513-50mg
1 Disponible
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246,90US$

370,90US$
Guardar 124,00 US$ (33.43%)
100mg
B413513-100mg
Fabricado bajo pedido · 8–12 semanas

396,90US$

595,90US$
Guardar 199,00 US$ (33.39%)
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SDS
Safety data
COA
Certificate
DS
Datasheet
SP
Spec sheet
Descripción general Specifications Propiedades del producto Nombres e identificadores Documentation Advanced Data Taxonomic Classification Estructura 3D Objetivos asociados (humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Calculadoras de soluciones Reseñas
🧪
Why this grade

≥97% 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

Information

BI-4464 is a highly selective ATP competitive inhibitor of PTK2/FAK , with an IC50 of 17 nM.


Targets

PTK2/FAK (Cell-free assay) 17 nM

Specifications

Sinónimos
3-Methoxy-N-(1-methylpiperidin-4-yl)-4-((4-((3-oxo-2,3-dihydro-1H-inden-4-yl)oxy)-5-(trifluoromethyl)pyrimidin-2-yl)amino)benzamide
Especificaciones y pureza
≥97%
Mecanismos bioquímicos y fisiológicos
BI-4464 is a highly selective ATP competitive inhibitor of PTK2/FAK, with an IC50 of 17 nM.
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.
Tipo de acción
INHIBITOR
Pureza
≥97%
Propiedades del producto
ALogP
4.531
hba_count
6
Recuento HBD
2
Enlace rotable
8
Nombres e identificadores
Pubchem Sid
488201930
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488201930
Sonrisas canónicas
CN1CCC(CC1)NC(=O)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)OC4=CC=CC5=C4C(=O)CC5)C(F)(F)F)OC
IUPAC Name
3-methoxy-N-(1-methylpiperidin-4-yl)-4-[[4-[(3-oxo-1,2-dihydroinden-4-yl)oxy]-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide
InChIKey
QUSSZSMDFABHLI-UHFFFAOYSA-N
INCHI
1S/C28H28F3N5O4/c1-36-12-10-18(11-13-36)33-25(38)17-6-8-20(23(14-17)39-2)34-27-32-15-19(28(29,30)31)26(35-27)40-22-5-3-4-16-7-9-21(37)24(16)22/h3-6,8,14-15,18H,7,9-13H2,1-2H3,(H,33,38)(H,32,34,35)
Isómeros SMILES
CN1CCC(CC1)NC(=O)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)OC4=CC=CC5=C4C(=O)CC5)C(F)(F)F)OC
Peso molecular
555.55
Reaxy-Rn
20458328
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=20458328&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
SuperclassOrganic oxygen compounds
ClaseOrganooxygen compounds
SubclassEthers
Intermediate Tree Nodes Not available
Direct ParentDiarylethers
Alternative Parents Indanones  Benzamides  Methoxyanilines  Anisoles  Aryl alkyl ketones  Benzoyl derivatives  Methoxybenzenes  Phenoxy compounds  Aminopyrimidines and derivatives  Alkyl aryl ethers  Piperidines  Heteroaromatic compounds  Secondary carboxylic acid amides  Trialkylamines  Amino acids and derivatives  Secondary amines  Azacyclic compounds  Hydrocarbon derivatives  Organic oxides  Alkyl fluorides  Organofluorides  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Diaryl ether - Indanone - Benzamide - Benzoic acid or derivatives - Indane - Methoxyaniline - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Aryl ketone - Aryl alkyl ketone - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Aminopyrimidine - Pyrimidine - Piperidine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Ketone - Carboxamide group - Azacycle - Secondary amine - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Amine - Alkyl fluoride - Alkyl halide - Organic oxide - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as diarylethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are aryl groups.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
PTK2 Tclin Focal adhesion kinase 1 (3 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
PTK2 Tclin Focal adhesion kinase 1 (4730 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HuCCT-1 (128 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Huh-7 (12904 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SK-HEP1 (1155 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SNU-398 (481 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HLE (117 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SNU-387 (161 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.

10 results found

Lot NumberCertificate TypeFechaArticulo
E23291065Certificate of AnalysisMar 11, 2026 B413513
E23291066Certificate of AnalysisMar 11, 2026 B413513
E2329554Certificate of AnalysisMar 11, 2026 B413513
E2329555Certificate of AnalysisMar 11, 2026 B413513
E2329556Certificate of AnalysisMar 11, 2026 B413513
E2329557Certificate of AnalysisMar 11, 2026 B413513
E2329559Certificate of AnalysisMar 11, 2026 B413513
E2329561Certificate of AnalysisMar 11, 2026 B413513
E2329553Certificate of AnalysisApr 28, 2023 B413513
E2329560Certificate of AnalysisApr 28, 2023 B413513
Propiedades químicas y físicas
SolubilidadSolubility (25°C) In vitro DMSO: 25 mg/mL (45.0 mM); Ethanol: 18 mg/mL (32.4 mM); Water: Insoluble;
SensibilidadMoisture sensitive
DMSO (mg/ml) Solubilidad máxima25
DMSO (mM) Solubilidad máxima45.0004500045001
Agua (mg/ml) Solubilidad máxima＜1
Peso molecular555.500 g/mol
XLogP34.400
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Exact Mass555.209 Da
Monoisotopic Mass555.209 Da
Topological Polar Surface Area106.000 Ų
Heavy Atom Count40
Formal Charge0
Complexity886.000
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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