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TRi-1 - ≥99% , CAS No.246020-68-8

CAS: 246020-68-8 Cat. No.: T412286 分子式: C12H9ClN2O5S 分子量: 328.73 PubChem CID: 2801235
COA
TRi-1 - ≥99% CAS No(246020-68-8) by Aladdin Scientific
注文可能
グレード＆純度 ≥99%
Synonyms
HUN20688 | TXNRD1 inhibitor 1 | 2-​[(4-​Chlorophenyl)​sulfonyl]​-​6-​methoxy-​3-​nitro-pyridine
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
サイズ
USA
ドイツ (EU)*
価格
個数
1mg
T412286-1mg
5 在庫あり
—

$83.90

$125.90
保存 $42.00 (33.36%)
5mg
T412286-5mg
5 在庫あり
—

$177.90

$266.90
保存 $89.00 (33.35%)
10mg
T412286-10mg
5 在庫あり
—

$276.90

$415.90
保存 $139.00 (33.42%)
50mg
T412286-50mg
5 在庫あり
—

$642.90

$964.90
保存 $322.00 (33.37%)
100mg
T412286-100mg
5 在庫あり
—

$939.90

$1,409.90
保存 $470.00 (33.34%)
Enter a quantity for the sizes you want to add.
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SDS
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COA
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DS
データシート
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仕様書
概要 仕様 製品の性質 名前と識別子 ドキュメント 詳細データ 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 よくある質問
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このグレードを選ぶ理由

≥99% ベースライン干渉を最小限に抑える必要がある、感度の高いクロマトグラフィーおよび分析ワークフロー向け。

🌡

保管・配送

Store at -20°C Ice chest + Ice pads に出荷。正確な仕様については、ロット固有の COA をご確認ください。

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品質書類

SDS、COA、データシート、仕様書をダウンロードできます。ロット固有の COA はロット番号検索で入手可能です。

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文献的裏付け

クロマトグラフィー、有機合成、クロスカップリング反応に関する 0 件の査読済み論文で引用されています。

概要

Information

TRi-1 TRi-1 (HUN20688, TXNRD1 inhibitor 1) is a potent, specific and irreversible cytosolic thioredoxin reductase 1 (TXNRD1) inhibitor with IC50 of 12 nM. TRi-1 exhibits anti-cancer activity while having little mitochondrial toxicity.

仕様

同義語
HUN20688 | TXNRD1 inhibitor 1 | 2-​[(4-​Chlorophenyl)​sulfonyl]​-​6-​methoxy-​3-​nitro-pyridine
仕様と純度
≥99%
生化学的・生理学的メカニズム
TRi-1 (HUN20688, TXNRD1 inhibitor 1) is a potent, specific and irreversible cytosolic thioredoxin reductase 1 (TXNRD1) inhibitor with IC50 of 12 nM. TRi-1 exhibits anti-cancer activity while having little mitochondrial toxicity.
保管条件
Store at -20°C
入荷
Ice chest + Ice pads
この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。
純度
≥99%
製品の性質
ALogP
3.402
回転可能な結合
4
名前と識別子
パブケム・シド
488194049
パブケム・シド・ウル
https://pubchem.ncbi.nlm.nih.gov/substance/488194049
カノニカル・スマイル
COC1=NC(=C(C=C1)[N+](=O)[O-])S(=O)(=O)C2=CC=C(C=C2)Cl
IUPAC Name
2-(4-chlorophenyl)sulfonyl-6-methoxy-3-nitropyridine
InChIKey
PRKWNRUVAZZHPH-UHFFFAOYSA-N
INCHI
1S/C12H9ClN2O5S/c1-20-11-7-6-10(15(16)17)12(14-11)21(18,19)9-4-2-8(13)3-5-9/h2-7H,1H3
異性体SMILES
COC1=NC(=C(C=C1)[N+](=O)[O-])S(=O)(=O)C2=CC=C(C=C2)Cl
PubChem CID
2801235
分子量
328.73

ドキュメント

📋 安全データシート（SDS）

危険性、取扱い、保管、および規制遵守を網羅した包括的な文書。

<<<<<<< HEAD SDS をダウンロード → ======= SDS をダウンロード → >>>>>>> release248-p3

✅ 分析証明書（COA）

ロット固有の品質データ。ロット番号を入力して、正確な COA を取得してください。

COA を検索 →

📊 データシート

製品仕様と用途のクイックリファレンス概要。

データシートを見る →

🔬 仕様書

このグレードの完全な品質特性と合格基準。

仕様書を見る →

詳細データ

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
分類Benzene and substituted derivatives
SubclassBenzenesulfonyl compounds
Intermediate Tree Nodes Not available
Direct ParentBenzenesulfonyl compounds
Alternative Parents Nitroaromatic compounds  Chlorobenzenes  Alkyl aryl ethers  Pyridines and derivatives  Aryl chlorides  Sulfones  Heteroaromatic compounds  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Benzenesulfonyl group - Nitroaromatic compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Pyridine - Heteroaromatic compound - Sulfone - Sulfonyl - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Ether - Organic oxoazanium - Organosulfur compound - Organochloride - Organonitrogen compound - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
説明This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.
External Descriptors Not available
3 D構造
インタラクティブ化学構造モデル





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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.

10 results found

Lot NumberCertificate Type日付商品
C23311381C23311381Certificate of AnalysisJan 16, 2023 T412286
C23311382C23311382Certificate of AnalysisJan 16, 2023 T412286
C23311383C23311383Certificate of AnalysisJan 16, 2023 T412286
C23311384C23311384Certificate of AnalysisJan 16, 2023 T412286
C23311385C23311385Certificate of AnalysisJan 16, 2023 T412286
C23311387C23311387Certificate of AnalysisJan 16, 2023 T412286
C23311460C23311460Certificate of AnalysisJan 16, 2023 T412286
C23311461C23311461Certificate of AnalysisJan 16, 2023 T412286
C23311462C23311462Certificate of AnalysisJan 16, 2023 T412286
C23311463C23311463Certificate of AnalysisJan 16, 2023 T412286
化学的性質と物理的性質
溶解度Solubility (25°C) In vitro DMSO: 28 mg/mL warmed with 50ºC Water: bath (85.17 mM); Water: Insoluble; Ethanol: Insoluble;
DMSO（mg / mL） 最大溶解度28
DMSO（mM） 最大溶解度85.1762844887902
水（mg / mL） 最大溶解度＜1
分子量328.730 g/mol
XLogP32.700
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass327.992 Da
Monoisotopic Mass327.992 Da
Topological Polar Surface Area110.000 Ų
Heavy Atom Count21
Formal Charge0
Complexity467.000
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
レビュー

顧客レビュー

よくある質問

What is the purity of this product?
This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.
How should this product be stored?
Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.
How is this product shipped?
This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 246020-68-8, the molecular formula is C12H9ClN2O5S, and the molecular weight is 328.73 g/mol. InChIKey PRKWNRUVAZZHPH-UHFFFAOYSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.
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