BMS 566419 - ≥98%(HPLC) , CAS No.566161-24-8

CAS: 566161-24-8 Cat. No.: B287051 Summenformel: C28H30FN5O2 Molekulargewicht: 487.57
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GRADE & PURITY ≥98%(HPLC)
Synonyms
Acridone-Based Inhibitor, 4m | UNII-9688E11ZQ0 | N-(2-(6-(4-ethylpiperazin-1-yl)pyridin-3-yl)propan-2-yl)-2-fluoro-9-oxo-9,10-dihydroacridine-3-carboxamide | 9688E11ZQ0 | BDBM19289 | BMS-566419 | Q27271886 | n-[1-[6-(4-ethyl-1-piperazinyl)-3-pyridinyl]-1-
Storage
Lagerung bei -20°C
Shipped In
Eistruhe + Eispads
★
Size
Deutschland (EU)
USA*
Price
Qty
1mg
B287051-1mg
—
2 Auf Lager
65,86€
5mg
B287051-5mg
—
2 Auf Lager
225,53€
10mg
B287051-10mg
—
1 Auf Lager
356,55€
25mg
B287051-25mg
—
2 Auf Lager
763,52€
50mg
B287051-50mg
—
1 Auf Lager
1.351,85€
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.

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Storage & shipping

Lagerung bei -20°C Ships Eistruhe + Eispads Check lot-specific COA for exact specifications.

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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

Synonyme
Acridone-Based Inhibitor, 4m | UNII-9688E11ZQ0 | N-(2-(6-(4-ethylpiperazin-1-yl)pyridin-3-yl)propan-2-yl)-2-fluoro-9-oxo-9,10-dihydroacridine-3-carboxamide | 9688E11ZQ0 | BDBM19289 | BMS-566419 | Q27271886 | n-[1-[6-(4-ethyl-1-piperazinyl)-3-pyridinyl]-1-
Spezifikationen & Reinheit
≥98%(HPLC)
Biochemische und physiologische Mechanismen
Starker Inosin-Monophosphat-Dehydrogenase (IMPDH)-Inhibitor (IC50= 17 nM). Hemmt die Proliferation von menschlichen T-Lymphoblasten und PBMCs in vitro. Verringert die Schwellung der Pfoten in einem Adjuvans-Arthritis-Modell der Ratte. Oral verfügbar.
Storage
Lagerung bei -20°C
Verschickt in
Eistruhe + Eispads
Reinheit
≥98%(HPLC)
Namen und Kennungen
Pubchem Sid528763464
Kanonisches LächelnCCN1CCN(CC1)C2=NC=C(C=C2)C(C)(C)NC(=O)C3=C(C=C4C(=C3)NC5=CC=CC=C5C4=O)F
IUPAC NameN-[2-[6-(4-ethylpiperazin-1-yl)pyridin-3-yl]propan-2-yl]-2-fluoro-9-oxo-10H-acridine-3-carboxamide
InChIKeyXEVJUIZOZCFECP-UHFFFAOYSA-N
INCHI1S/C28H30FN5O2/c1-4-33-11-13-34(14-12-33)25-10-9-18(17-30-25)28(2,3)32-27(36)20-16-24-21(15-22(20)29)26(35)19-7-5-6-8-23(19)31-24/h5-10,15-17H,4,11-14H2,1-3H3,(H,31,35)(H,32,36)
Isomere SMILES CCN1CCN(CC1)C2=NC=C(C=C2)C(C)(C)NC(=O)C3=C(C=C4C(=C3)NC5=CC=CC=C5C4=O)F
Molekulargewicht 487.57
Reaxy-Rn 11171623
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11171623&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
KlasseQuinolines and derivatives
SubclassBenzoquinolines
Intermediate Tree Nodes Acridines
Direct ParentAcridones
Alternative Parents Quinoline carboxamides  Fluoroquinolones  N-arylpiperazines  Pyridinylpiperazines  Haloquinolines  Hydroquinolones  2-halobenzoic acids and derivatives  Hydroquinolines  Dialkylarylamines  N-alkylpiperazines  Aminopyridines and derivatives  Imidolactams  Aryl fluorides  Heteroaromatic compounds  Vinylogous halides  Vinylogous amides  Amino acids and derivatives  Secondary carboxylic acid amides  Trialkylamines  Azacyclic compounds  Organofluorides  Organooxygen compounds  Hydrocarbon derivatives  Organic oxides  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Acridone - Quinoline-7-carboxamide - Fluoroquinolone - Pyridinylpiperazine - N-arylpiperazine - Haloquinoline - Dihydroquinolone - Dihydroquinoline - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Dialkylarylamine - Aminopyridine - N-alkylpiperazine - Aryl fluoride - Aryl halide - 1,4-diazinane - Piperazine - Pyridine - Imidolactam - Benzenoid - Heteroaromatic compound - Vinylogous halide - Vinylogous amide - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as acridones. These are acridines containing a ketone group attached to the C9 carbon atom of the acridine moiety.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zugehörige Ziele (menschlich)
IMPDH2 Tclin Inosine-5'-monophosphate dehydrogenase 2 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
IMPDH2 Tclin Inosine-5'-monophosphate dehydrogenase 2 (1326 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KCNH2 Tclin HERG (29587 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2D6 Tclin Cytochrome P450 2D6 (33882 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP1A2 Tchem Cytochrome P450 1A2 (26471 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2C9 Tchem Cytochrome P450 2C9 (32119 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2C19 Tchem Cytochrome P450 2C19 (29246 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Caco-2 (12174 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CCRF-CEM (65223 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PBMC (10003 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Zugehörige Ziele (nicht menschlich)
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Cynomolgus monkey (4946 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Serum (58 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:

Find and download the COA for your product by matching the lot number on the packaging.

10 results found

Lot NumberCertificate TypeDatumArtikel
D2403119Certificate of AnalysisFeb 19, 2024 B287051
D2403120Certificate of AnalysisFeb 19, 2024 B287051
D2403121Certificate of AnalysisFeb 19, 2024 B287051
D2403122Certificate of AnalysisFeb 19, 2024 B287051
D2403123Certificate of AnalysisFeb 19, 2024 B287051
D2403124Certificate of AnalysisFeb 19, 2024 B287051
D2403125Certificate of AnalysisFeb 19, 2024 B287051
D2403126Certificate of AnalysisFeb 19, 2024 B287051
D2403127Certificate of AnalysisFeb 19, 2024 B287051
D2403128Certificate of AnalysisFeb 19, 2024 B287051
Chemische und physikalische Eigenschaften
LöslichkeitSolvent:1eq. HCl, Max Conc. mg/mL: 24.38, Max Conc. mM: 50; Solvent:DMSO, Max Conc. mg/mL: 48.76, Max Conc. mM: 100
Molekulargewicht487.600 g/mol
XLogP34.000
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass487.238 Da
Monoisotopic Mass487.238 Da
Topological Polar Surface Area77.600 Ų
Heavy Atom Count36
Formal Charge0
Complexity801.000
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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