WAY-620473 - ≥98% , CAS No.743451-55-0

CAS: 743451-55-0 Cat. No.: W418401 Summenformel: C17H20N4O3 Molekulargewicht: 328.371 PubChem CID: 135462119
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GRADE & PURITY ≥98%
Storage
Room temperature
★
Size
Deutschland (EU)
USA*
Price
Qty
25mg
W418401-25mg
—
2 Auf Lager

80,61€

121,40€
Speichern 40,78 € (33.60%)
50mg
W418401-50mg
—
2 Auf Lager

129,21€

194,29€
Speichern 65,08 € (33.50%)
100mg
W418401-100mg
—
1 Auf Lager

207,30€

311,43€
Speichern 104,13 € (33.44%)
250mg
W418401-250mg
—
1 Auf Lager

412,09€

618,61€
Speichern 206,52 € (33.38%)
500mg
W418401-500mg
—
1 Auf Lager

741,83€

1.113,22€
Speichern 371,39 € (33.36%)
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships 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.

Übersicht

PARP-1 inhibitor; altering the lifespan of a eukaryotic organism;

Specifications

Spezifikationen & Reinheit
≥98%
Storage
Room temperature
Reinheit
≥98%
Produkteigenschaften
ALogP-0.067
HBD-Zahl2
Rotationsfähige Bindung4
Namen und Kennungen
Pubchem Sid488202927
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488202927
Kanonisches LächelnC1CN(CCC1C(=O)N)C(=O)CCC2=NC3=CC=CC=C3C(=O)N2
IUPAC Name1-[3-(4-oxo-3H-quinazolin-2-yl)propanoyl]piperidine-4-carboxamide
InChIKeyLWSPTTXDACSZCA-UHFFFAOYSA-N
INCHI1S/C17H20N4O3/c18-16(23)11-7-9-21(10-8-11)15(22)6-5-14-19-13-4-2-1-3-12(13)17(24)20-14/h1-4,11H,5-10H2,(H2,18,23)(H,19,20,24)
Isomere SMILES C1CN(CCC1C(=O)N)C(=O)CCC2=NC3=CC=CC=C3C(=O)N2
PubChem CID 135462119
Molekulargewicht 328.371

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
KlasseDiazanaphthalenes
SubclassBenzodiazines
Intermediate Tree Nodes Not available
Direct ParentQuinazolines
Alternative Parents Piperidinecarboxamides  N-acylpiperidines  Pyrimidones  Benzenoids  Vinylogous amides  Tertiary carboxylic acid amides  Heteroaromatic compounds  Primary carboxylic acid amides  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Quinazoline - N-acyl-piperidine - Piperidinecarboxamide - Pyrimidone - Piperidine - Pyrimidine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Tertiary carboxylic acid amide - Carboxamide group - Primary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zugehörige Ziele (menschlich)
PARP1 Tclin Poly [ADP-ribose] polymerase 1 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
CYP2D6 Tclin Cytochrome P450 2D6 (33882 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PARP1 Tclin Poly [ADP-ribose] polymerase-1 (6206 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
POLI Tchem DNA polymerase iota (116820 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Zugehörige Ziele (nicht menschlich)
GCN5 Histone acetyltransferase GCN5 (89 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.

11 results found

Lot NumberCertificate TypeDatumArtikel
C2618205Certificate of AnalysisMar 28, 2026 W418401
D2307119Certificate of AnalysisJan 21, 2026 W418401
D2307125Certificate of AnalysisJan 21, 2026 W418401
D2307130Certificate of AnalysisJan 21, 2026 W418401
D2307131Certificate of AnalysisJan 21, 2026 W418401
D2307132Certificate of AnalysisJan 21, 2026 W418401
D2307145Certificate of AnalysisJan 21, 2026 W418401
D2307148Certificate of AnalysisJan 21, 2026 W418401
D2307149Certificate of AnalysisJan 21, 2026 W418401
D2307150Certificate of AnalysisJan 21, 2026 W418401
D2307151Certificate of AnalysisJan 21, 2026 W418401

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Chemische und physikalische Eigenschaften
DMSO (mM) Maximale Löslichkeit10
Molekulargewicht328.400 g/mol
XLogP3-0.600
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass328.154 Da
Monoisotopic Mass328.154 Da
Topological Polar Surface Area105.000 Ų
Heavy Atom Count24
Formal Charge0
Complexity552.000
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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