ML348(Cas No 899713-86-1) ≥98% high purity and research grade

Name: ML348 - ≥98% , CAS No.899713-86-1
Brand: Aladdin Scientific
SKU: M304853
Availability: InStock

ML348 - ≥98% , CAS No.899713-86-1

CAS: 899713-86-1 Cat. No.: M304853 分子式: C₁₈H₁₇ClF₃N₃O₃ 分子量: 415.79 EC番号: 809-791-4

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ML348 - ≥98% CAS No(899713-86-1) by Aladdin Scientific

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注文可能

グレード＆純度 ≥98%

Synonyms

N-(2-chloro-5-(trifluoromethyl)phenyl)-2-(4-(furan-2-carbonyl)piperazin-1-yl)acetamide | BCP18861 | MFCD05123530 | SR-01000595170-5 | STL419865 | AS-16715 | SR-01000595170-3 | AKOS002133531 | ML-348(ML348) | BDBM207991 | SR-01000595170-4 | MLS004819989 |

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

仕様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よくある質問と記事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

≥98% 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。

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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。

仕様

同義語

仕様と純度

≥98%

生化学的・生理学的メカニズム

Selective and reversible lysophospholipase 1 (LYPLA1) inhibitor (IC50= 210 nM). Exhibits 14-fold selectivity for LYPLA1 over LYPLA2. Also selective over a panel of ~30 other serine hydrolases.

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

≥98%

名前と識別子

パブケム・シド

504762502

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/504762502

カノニカル・スマイル

C1CN(CCN1CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)C(=O)C3=CC=CO3

IUPAC Name

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide

InChIKey

OXKNHBBDOIMFFQ-UHFFFAOYSA-N

INCHI

1S/C18H17ClF3N3O3/c19-13-4-3-12(18(20,21)22)10-14(13)23-16(26)11-24-5-7-25(8-6-24)17(27)15-2-1-9-28-15/h1-4,9-10H,5-8,11H2,(H,23,26)

異性体SMILES

C1CN(CCN1CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)C(=O)C3=CC=CO3

分子量

415.79

Reaxy-Rn

22801381

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22801381&ln=

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

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - 分類 Carboxylic acids and derivatives
    - Subclass Amino acids, peptides, and analogues
      - Level5 Amino acids and derivatives
        Level6 Alpha amino acids and derivatives
        Level7 Alpha amino acid amides

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
分類	Carboxylic acids and derivatives
Subclass	Amino acids, peptides, and analogues
Intermediate Tree Nodes	Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent	Alpha amino acid amides
Alternative Parents	Trifluoromethylbenzenes N-piperazineacetamides Anilides 2-heteroaryl carboxamides N-arylamides Furoic acid and derivatives N-alkylpiperazines Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Alkyl fluorides Organofluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Alpha-amino acid amide - Trifluoromethylbenzene - N-piperazineacetamide - Anilide - 2-heteroaryl carboxamide - Furoic acid or derivatives - N-arylamide - Chlorobenzene - Halobenzene - N-alkylpiperazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Furan - Tertiary amine - Secondary carboxylic acid amide - Tertiary aliphatic amine - Carboxamide group - Azacycle - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic oxygen compound - Organohalogen compound - Carbonyl group - Organic nitrogen compound - Alkyl halide - Organochloride - Organofluoride - Organonitrogen compound - Alkyl fluoride - Aromatic heteromonocyclic compound
説明	This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

3 D構造

Lot Number	Certificate Type	日付	商品
L2418185	Certificate of Analysis	Dec 27, 2024	M304853
J2128265	Certificate of Analysis	Aug 13, 2024	M304853
J2128266	Certificate of Analysis	Aug 13, 2024	M304853
J2129150	Certificate of Analysis	Aug 13, 2024	M304853
J2129151	Certificate of Analysis	Aug 13, 2024	M304853

溶解度	Solvent:DMSO, Max Conc. mg/mL: 41.58, Max Conc. mM: 100
分子量	415.800 g/mol
XLogP3	3.000
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	415.091 Da
Monoisotopic Mass	415.091 Da
Topological Polar Surface Area	65.800 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	570.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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レビュー

よくある質問

What is the purity of this product?

This product is supplied at ≥98% 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 899713-86-1, the molecular formula is C18H17ClF3N3O3, and the molecular weight is 415.79 g/mol. InChIKey OXKNHBBDOIMFFQ-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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