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アルベレスタット - モリガンド™, ≥98 , Leukocyte elastase inhibitor, CAS No.848141-11-7, Leukocyte elastase inhibitor

CAS: 848141-11-7 Cat. No.: A127407 分子式: C25H22F3N5O4S 分子量: 545.53
COA
アルベレスタット - モリガンド™, ≥98 CAS No(848141-11-7) by Aladdin Scientific
注文可能
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
Synonyms
NCGC00378593-07 | NSC60020 | 6-Methyl-5-(1-methyl-1H-pyrazol-5-yl)-N-{[5-(methylsulfonyl)pyridin-2-yl]methyl}-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2-dihydropyridine-3-carboxamide | NCGC00254369-01 | C76706 | Alvelestat (AZD9668) | DB11863 | FT-0722953 |
Storage
20℃で保存
Shipped In
アイスチェスト＋アイスパッド
★
Size
USA
ドイツ (EU)*
Price
Qty
5mg
A127407-5mg
3 在庫あり
—

$33.90

$50.90
保存 $17.00 (33.40%)
10mg
A127407-10mg
2 在庫あり
—

$45.90

$68.90
保存 $23.00 (33.38%)
25mg
A127407-25mg
2 在庫あり
—

$100.90

$151.90
保存 $51.00 (33.57%)
50mg
A127407-50mg
受注生産 · 8～12週間

$120.90

$181.90
保存 $61.00 (33.53%)
100mg
A127407-100mg
受注生産 · 8～12週間

$185.90

$278.90
保存 $93.00 (33.35%)
Enter a quantity for the sizes you want to add.
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SDS
Safety data
COA
Certificate
DS
Datasheet
SP
Spec sheet
概要 Specifications 製品の性質 名前と識別子 Documentation Advanced Data Taxonomic Classification 3 D構造 関連ターゲット（人間） 関連ターゲット（非人間） 作用メカニズム 証明書（CoA、COO、BSE/TSEと分析図） 化学的性質と物理的性質 ソリューション計算機 レビュー
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Why this grade

モリガンド™, ≥98 Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

20℃で保存 Ships アイスチェスト＋アイスパッド 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.

概要

アルベレスタット（AZD9668）は、経口の好中球エラスターゼ（NE）高選択的阻害剤であり、IC50は12 nM、Kiは9.4 nMで、他のセリンプロテアーゼに比べて少なくとも600倍の選択性を有する。

Specifications

同義語
NCGC00378593-07 | NSC60020 | 6-Methyl-5-(1-methyl-1H-pyrazol-5-yl)-N-{[5-(methylsulfonyl)pyridin-2-yl]methyl}-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2-dihydropyridine-3-carboxamide | NCGC00254369-01 | C76706 | Alvelestat (AZD9668) | DB11863 | FT-0722953 |
仕様と純度
モリガンド™, ≥98
生化学的・生理学的メカニズム
アルベレスタット（AZD9668）は、新規の経口好中球エラスターゼ（NE）阻害剤で、ヒトNEに対するpIC50は7 9である。
保管条件
20℃で保存
入荷
アイスチェスト＋アイスパッド
等級
Moligand™
アクションタイプ
INHIBITOR
作用メカニズム
Leukocyte elastase inhibitor
純度
≥98%
製品の性質
ALogP
2.5
名前と識別子
パブケム・シド
528776293
パブケム・シド・ウル
https://pubchem.ncbi.nlm.nih.gov/substance/528776293
カノニカル・スマイル
CC1=C(C=C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC3=NC=C(C=C3)S(=O)(=O)C)C4=CC=NN4C
IUPAC Name
6-methyl-5-(2-methylpyrazol-3-yl)-N-[(5-methylsulfonylpyridin-2-yl)methyl]-2-oxo-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
InChIKey
QNQZWEGMKJBHEM-UHFFFAOYSA-N
INCHI
1S/C25H22F3N5O4S/c1-15-20(22-9-10-31-32(22)2)12-21(23(34)30-13-17-7-8-19(14-29-17)38(3,36)37)24(35)33(15)18-6-4-5-16(11-18)25(26,27)28/h4-12,14H,13H2,1-3H3,(H,30,34)
異性体SMILES
CC1=C(C=C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC3=NC=C(C=C3)S(=O)(=O)C)C4=CC=NN4C
分子量
545.53
Reaxy-Rn
12029447
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=12029447&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
分類Pyridines and derivatives
SubclassPyrazolylpyridines
Intermediate Tree Nodes Not available
Direct ParentPyrazolylpyridines
Alternative Parents Trifluoromethylbenzenes  Nicotinamides  Pyridinones  Dihydropyridines  Methylpyridines  Vinylogous amides  Sulfones  Pyrazoles  Heteroaromatic compounds  Secondary carboxylic acid amides  Lactams  Azacyclic compounds  Organic oxides  Hydrocarbon derivatives  Organofluorides  Organonitrogen compounds  Organooxygen compounds  Alkyl fluorides  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents 3-pyrazolylpyridine - Trifluoromethylbenzene - Nicotinamide - Pyridine carboxylic acid or derivatives - Dihydropyridine - Methylpyridine - Pyridinone - Monocyclic benzene moiety - Hydropyridine - Benzenoid - Azole - Pyrazole - Heteroaromatic compound - Vinylogous amide - Sulfone - Sulfonyl - Carboxamide group - Secondary carboxylic acid amide - Lactam - Azacycle - Carboxylic acid derivative - Alkyl halide - Organohalogen compound - Hydrocarbon derivative - Organofluoride - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
説明This compound belongs to the class of organic compounds known as pyrazolylpyridines. These are compounds containing a pyrazolylpyridine skeleton, which consists of a pyrazole linked (not fused) to a pyridine by a bond.
External Descriptors Not available
3 D構造
インタラクティブ化学構造モデル





関連ターゲット（人間）
ELANE Tclin Neutrophil elastase (3 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ELANE Tclin Leukocyte elastase (8173 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Homo sapiens (32628 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
関連ターゲット（非人間）
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
作用メカニズム
証明書（CoA、COO、BSE/TSEと分析図）
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.

1 results found

Lot NumberCertificate Type日付商品
D1517081Certificate of AnalysisJun 15, 2026 A127407
化学的性質と物理的性質
溶解度25°C: DMSO
分子量545.500 g/mol
XLogP32.500
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Exact Mass545.134 Da
Monoisotopic Mass545.134 Da
Topological Polar Surface Area123.000 Ų
Heavy Atom Count38
Formal Charge0
Complexity1100.000
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
ソリューション計算機
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