HKI 357 - ≥98%(HPLC) , CAS No.848133-17-5

Name: HKI 357 - ≥98%(HPLC) , CAS No.848133-17-5
Brand: Aladdin Scientific
SKU: H286774
Availability: InStock

CAS: 848133-17-5 Cat. No.: H286774 Summenformel: C₃₁H₂₉ClFN₅O₃ Molekulargewicht: 574.05 PubChem CID: 11238512

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QUALITÄT & REINHEIT ≥98%(HPLC)

Synonyms

4-Dimethylamino-but-2-enoic acid {4-[3-chloro-4-(3-fluoro-benzyloxy)-phenylamino]-3-cyano-7-ethoxy-quinolin-6-yl}-amide | A900842 | Q27256922 | YIB13317 | 2-Butenamide, N-(4-((3-chloro-4-((3-fluorophenyl)methoxy)phenyl)amino)-3-cyano-7-ethoxy-6-quinolinyl

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Spezifikationen Namen und Kennungen Dokumentation Erweiterte Daten Taxonomic Classification 3D-Struktur Zugehörige Ziele (menschlich) Zugehörige Ziele (nicht menschlich) Wirkungsmechanismen Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm) Chemische und physikalische Eigenschaften FAQs und Artikel Lösungsrechner Bewertungen

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Warum diese Qualität

≥98%(HPLC) für empfindliche chromatographische und analytische Workflows, die minimale Basislinieninterferenzen erfordern.

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Lagerung & Versand

Store at -20°C Versand Ice chest + Ice pads. Genaue Spezifikationen finden Sie im chargenspezifischen COA.

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Qualitätsdokumente

SDS, COA, Datenblatt und Spezifikationsblatt stehen zum Download bereit. Chargenspezifische COA über Chargennummernsuche abrufbar.

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Literaturbeleg

In 0 peer-reviewten Publikationen zu Chromatographie, organischer Synthese und Kreuzkupplungsreaktionen zitiert.

Spezifikationen

Synonyme

Spezifikationen & Reinheit

≥98%(HPLC)

Biochemische und physiologische Mechanismen

Potent, irreversible inhibitor of ErbB2 (HER2) and EGFR (IC50values are 33 and 34 nM respectively). Suppresses ligand-induced EGFR autophosphorylation and cell proliferation in NCI-H1975 cells containing L858R and T790M mutations. Circumvents mechanisms o

Storage

Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Aktionsart

INHIBITOR

Reinheit

≥98%(HPLC)

Namen und Kennungen

Pubchem Sid

528764804

Kanonisches Lächeln

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC(=CC=C4)F)Cl)C#N)NC(=O)C=CCN(C)C

IUPAC Name

(E)-N-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]-3-cyano-7-ethoxyquinolin-6-yl]-4-(dimethylamino)but-2-enamide

InChIKey

NERXPXBELDBEPZ-RMKNXTFCSA-N

INCHI

1S/C31H29ClFN5O3/c1-4-40-29-16-26-24(15-27(29)37-30(39)9-6-12-38(2)3)31(21(17-34)18-35-26)36-23-10-11-28(25(32)14-23)41-19-20-7-5-8-22(33)13-20/h5-11,13-16,18H,4,12,19H2,1-3H3,(H,35,36)(H,37,39)/b9-6+

Isomere SMILES

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC(=CC=C4)F)Cl)C#N)NC(=O)/C=C/CN(C)C

PubChem CID

11238512

Molekulargewicht

574.05

Dokumentation

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Erweiterte Daten

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Klasse Quinolines and derivatives
    - Subclass Aminoquinolines and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Klasse	Quinolines and derivatives
Subclass	Aminoquinolines and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	4-aminoquinolines
Alternative Parents	Aminophenyl ethers Phenoxy compounds Aniline and substituted anilines N-arylamides Alkyl aryl ethers Aminopyridines and derivatives Chlorobenzenes Fluorobenzenes Primary aromatic amines Aryl chlorides Aryl fluorides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Trialkylamines Nitriles Azacyclic compounds Secondary amines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	4-aminoquinoline - Aminophenyl ether - Phenoxy compound - Phenol ether - N-arylamide - Aniline or substituted anilines - Alkyl aryl ether - Aminopyridine - Halobenzene - Fluorobenzene - Chlorobenzene - Primary aromatic amine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Aryl chloride - Pyridine - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Secondary amine - Nitrile - Carbonitrile - Azacycle - Carboxylic acid derivative - Ether - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Beschreibung	This compound belongs to the class of organic compounds known as 4-aminoquinolines. These are organic compounds containing an amino group attached to the 4-position of a quinoline ring system.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

3D-Struktur

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ABL1 Tclin Tyrosine-protein kinase ABL (18331 Activities)

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EGFR Tclin Epidermal growth factor receptor erbB1 (33727 Activities)

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ERBB2 Tclin Receptor protein-tyrosine kinase erbB-2 (7851 Activities)

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CSNK2A1 Tchem Casein kinase II alpha (3512 Activities)

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DAPK3 Tchem Death-associated protein kinase 3 (2108 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

NQO2 Tchem Quinone reductase 2 (885 Activities)

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MAPK14 Tchem MAP kinase p38 alpha (12866 Activities)

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GSK3B Tclin Glycogen synthase kinase-3 beta (11785 Activities)

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MAP2K6 Tchem Dual specificity mitogen-activated protein kinase kinase 6 (1284 Activities)

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FGFR2 Tclin Fibroblast growth factor receptor 2 (3405 Activities)

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FGFR1 Tclin Fibroblast growth factor receptor 1 (9149 Activities)

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STK3 Tchem Serine/threonine-protein kinase MST2 (3069 Activities)

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CSNK1D Tchem Casein kinase I delta (4546 Activities)

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CAMK2B Tchem CaM kinase II beta (1626 Activities)

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SRC Tclin Tyrosine-protein kinase SRC (10310 Activities)

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CHEK2 Tchem Serine/threonine-protein kinase Chk2 (4015 Activities)

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AKT3 Tchem Serine/threonine-protein kinase AKT3 (3157 Activities)

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PIM1 Tchem Serine/threonine-protein kinase PIM1 (9629 Activities)

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RPS6KA5 Tchem Ribosomal protein S6 kinase alpha 5 (3355 Activities)

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RPS6KA1 Tchem Ribosomal protein S6 kinase alpha 1 (2796 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CSNK1E Tclin Casein kinase I epsilon (1412 Activities)

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CAMK4 Tbio CaM kinase IV (2116 Activities)

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MAP2K4 Tchem Dual specificity mitogen-activated protein kinase kinase 4 (1051 Activities)

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MAPK13 Tchem MAP kinase p38 delta (2605 Activities)

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MAPKAPK2 Tchem MAP kinase-activated protein kinase 2 (4814 Activities)

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DAPK1 Tchem Death-associated protein kinase 1 (1664 Activities)

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MAPK9 Tchem c-Jun N-terminal kinase 2 (4655 Activities)

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MAPK10 Tchem c-Jun N-terminal kinase 3 (3396 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CAMK2D Tchem CaM kinase II delta (2813 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CDK2 Tchem Cyclin-dependent kinase 2 (9050 Activities)

Discover Target: CDK2

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DYRK1A Tchem Dual-specificity tyrosine-phosphorylation regulated kinase 1A (6484 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

MAPK8 Tchem c-Jun N-terminal kinase 1 (5038 Activities)

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PHKG2 Tchem Phosphorylase kinase gamma subunit 2 (2281 Activities)

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CSNK2A2 Tchem Casein kinase II alpha (prime) (1587 Activities)

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MAP2K7 Tchem Dual specificity mitogen-activated protein kinase kinase 7 (1145 Activities)

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AURKA Tchem Serine/threonine-protein kinase Aurora-A (10240 Activities)

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GAK Tchem Serine/threonine-protein kinase GAK (1150 Activities)

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AAK1 Tchem Adaptor-associated kinase (1053 Activities)

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PLK4 Tchem Serine/threonine-protein kinase PLK4 (1882 Activities)

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STK17B Tchem Serine/threonine-protein kinase 17B (773 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

STK10 Tchem Serine/threonine-protein kinase 10 (2119 Activities)

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EPHA2 Tclin Ephrin type-A receptor 2 (3499 Activities)

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TTK Tchem Dual specificity protein kinase TTK (2978 Activities)

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CLK1 Tchem Dual specificty protein kinase CLK1 (2189 Activities)

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CLK3 Tchem Dual specificity protein kinase CLK3 (2711 Activities)

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BMX Tchem Tyrosine-protein kinase BMX (1995 Activities)

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NEK2 Tchem Serine/threonine-protein kinase NEK2 (3514 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

EPHA5 Tchem Ephrin type-A receptor 5 (1056 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

EPHB1 Tchem Ephrin type-B receptor 1 (840 Activities)

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EPHA4 Tchem Ephrin type-A receptor 4 (2022 Activities)

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Mapk1 MAP kinase ERK2 (650 Activities)

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Hdac6 Histone deacetylase 6 (222 Activities)

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Fgfr3 Fibroblast growth factor receptor 3 (21 Activities)

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Mus musculus (284745 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

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SARS-CoV-2 (38078 Activities)

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Wirkungsmechanismen

Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Datum	Artikel
J2214378	Certificate of Analysis	Jul 10, 2025	H286774
J2214379	Certificate of Analysis	Jul 10, 2025	H286774
J2214380	Certificate of Analysis	Jul 10, 2025	H286774
J2214381	Certificate of Analysis	Jul 10, 2025	H286774
J2214384	Certificate of Analysis	Jul 10, 2025	H286774
K2413032	Certificate of Analysis	Jun 07, 2022	H286774

Chemische und physikalische Eigenschaften

Löslichkeit	Solvent:DMSO, Max Conc. mg/mL: 57.4, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 14.35, Max Conc. mM: 25
Molekulargewicht	574.000 g/mol
XLogP3	6.000
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	11
Exact Mass	573.194 Da
Monoisotopic Mass	573.194 Da
Topological Polar Surface Area	99.500 Å²
Heavy Atom Count	41
Formal Charge	0
Complexity	915.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	1
Covalently-Bonded Unit Count	1

FAQs und Artikel

Structural Features, Activation Logic, and Signaling Output of the ErbB Family Pathway

Categories: Technical Articles: Reagent Chemistry, Synthesis & Bioscience Guides

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EGFR PI3K-AKT ErbB HER2 HER3 HER4 Receptor tyrosine kinase RAS-ERK Dimerization

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