RAF709 - ≥98% , CAS No.1628838-42-5

CAS: 1628838-42-5 Cat. No.: R401072 Summenformel: C28H29F3N4O4 Molekulargewicht: 542.55 PubChem CID: 90408826
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QUALITÄT & REINHEIT ≥98%
Synonyms
N-[2-methyl-5'-(4-morpholinyl)-6'-[(tetrahydro-2H-pyran-4-yl)oxy][3,3'-bipyridin]-5-yl]-3-(trifluoromethyl)-benzamide
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
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Menge
1mg
R401072-1mg
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47,64€
5mg
R401072-5mg
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126,60€
25mg
R401072-25mg
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475,43€
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747,90€
100mg
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1.006,49€
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Warum diese Qualität

≥98% 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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Literaturbeleg

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

Spezifikationen

Synonyme
N-[2-methyl-5'-(4-morpholinyl)-6'-[(tetrahydro-2H-pyran-4-yl)oxy][3,3'-bipyridin]-5-yl]-3-(trifluoromethyl)-benzamide
Spezifikationen & Reinheit
≥98%
Storage
Store at -20°C
Verschickt in
Ice chest + Ice pads
Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.
Reinheit
≥98%
Namen und Kennungen
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504772578
Kanonisches Lächeln
CC1=C(C=C(C=N1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)C3=CC(=C(N=C3)OC4CCOCC4)N5CCOCC5
IUPAC Name
N-[6-methyl-5-[5-morpholin-4-yl-6-(oxan-4-yloxy)pyridin-3-yl]pyridin-3-yl]-3-(trifluoromethyl)benzamide
InChIKey
FYNMINFUAIDIFL-UHFFFAOYSA-N
INCHI
1S/C28H29F3N4O4/c1-18-24(15-22(17-32-18)34-26(36)19-3-2-4-21(13-19)28(29,30)31)20-14-25(35-7-11-38-12-8-35)27(33-16-20)39-23-5-9-37-10-6-23/h2-4,13-17,23H,5-12H2,1H3,(H,34,36)
Isomere SMILES
CC1=C(C=C(C=N1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)C3=CC(=C(N=C3)OC4CCOCC4)N5CCOCC5
PubChem CID
90408826
Molekulargewicht
542.55

Dokumentation

📋 Sicherheitsdatenblatt (SDS)

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<<<<<<< HEAD SDS herunterladen → ======= SDS herunterladen → >>>>>>> release248-p3

✅ Analysezertifikat (COA)

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Erweiterte Daten

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
KlassePyridines and derivatives
SubclassBipyridines and oligopyridines
Intermediate Tree Nodes Not available
Direct ParentBipyridines and oligopyridines
Alternative Parents Trifluoromethylbenzenes  Benzamides  Dialkylarylamines  Benzoyl derivatives  Alkyl aryl ethers  Aminopyridines and derivatives  Methylpyridines  Oxanes  Morpholines  Heteroaromatic compounds  Secondary carboxylic acid amides  Amino acids and derivatives  Oxacyclic compounds  Azacyclic compounds  Dialkyl ethers  Organic oxides  Alkyl fluorides  Hydrocarbon derivatives  Organofluorides  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Bipyridine - Trifluoromethylbenzene - Benzamide - Benzoic acid or derivatives - Benzoyl - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Methylpyridine - Aminopyridine - Alkyl aryl ether - Benzenoid - Oxazinane - Oxane - Monocyclic benzene moiety - Morpholine - Heteroaromatic compound - Amino acid or derivatives - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic oxide - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Alkyl fluoride - Organofluoride - Hydrocarbon derivative - Amine - Alkyl halide - Organohalogen compound - Aromatic heteromonocyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as bipyridines and oligopyridines. These are organic compounds containing two pyridine rings linked to each other.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zugehörige Ziele (menschlich)
RAF1 Tclin RAF proto-oncogene serine/threonine-protein kinase (3 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
BRAF Tclin Serine/threonine-protein kinase B-raf (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
RAF1 Tclin Serine/threonine-protein kinase RAF (4169 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PDGFRA Tclin Platelet-derived growth factor receptor alpha (5682 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
FRK Tchem Tyrosine-protein kinase FRK (2284 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Calu-6 (398 Activities)
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PC-3 (62116 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BRAF Tclin Serine/threonine-protein kinase B-raf (11587 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
DDR1 Tchem Epithelial discoidin domain-containing receptor 1 (1050 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
DDR2 Tchem Discoidin domain-containing receptor 2 (2199 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Zugehörige Ziele (nicht menschlich)
Canis familiaris (36305 Activities)
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Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Plasma (328 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Wirkungsmechanismen
Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

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5 results found

Lot NumberCertificate TypeDatumArtikel
A2211394A2211394Certificate of AnalysisOct 13, 2025 R401072
A2211468A2211468Certificate of AnalysisOct 13, 2025 R401072
A2211469A2211469Certificate of AnalysisOct 13, 2025 R401072
A2211470A2211470Certificate of AnalysisOct 13, 2025 R401072
A2211476A2211476Certificate of AnalysisOct 13, 2025 R401072
Chemische und physikalische Eigenschaften
LöslichkeitSoluble in DMSO, highest concentration (mg/mL): 100, highest concentration (mM): 184.31; soluble in Ethanol, highest concentration (mg/mL): 100, highest concentration (mM): 184.31
Molekulargewicht542.500 g/mol
XLogP34.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count6
Exact Mass542.214 Da
Monoisotopic Mass542.214 Da
Topological Polar Surface Area85.800 Ų
Heavy Atom Count39
Formal Charge0
Complexity793.000
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
Lösungsrechner
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