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ERK5-IN-2 - ≥98% , CAS No.1888305-96-1

CAS: 1888305-96-1 Cat. No.: E413634 分子式: C17H11BrFN3O2 分子量: 388.19
COA
ERK5-IN-2 - ≥98% CAS No(1888305-96-1) by Aladdin Scientific
注文可能
グレード＆純度 ≥98%
Synonyms
4-(2-Bromo-6-fluorobenzoyl)-N-(pyridin-3-yl)-1H-pyrrole-2-carboxamide
Storage
Protected from light,Store at -20°C
Shipped In
Ice chest + Ice pads
★
サイズ
USA
ドイツ (EU)*
価格
個数
5mg
E413634-5mg
受注生産 · 8～12週間

$14.90

$22.90
保存 $8.00 (34.93%)
10mg
E413634-10mg
2 在庫あり
—

$25.90

$38.90
保存 $13.00 (33.42%)
25mg
E413634-25mg
受注生産 · 8～12週間

$55.90

$83.90
保存 $28.00 (33.37%)
50mg
E413634-50mg
1 在庫あり
—

$94.90

$142.90
保存 $48.00 (33.59%)
100mg
E413634-100mg
受注生産 · 8～12週間

$159.90

$239.90
保存 $80.00 (33.35%)
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COA
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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
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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

Protected from light,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

ERK5-IN-2 is an orally active, sub-micromolar, selectiveERK5inhibitor with IC50 of 0.82 μM and 3 μM for ERK5 and ERK5 MEF2D, respectively.


Targets

ERK5 (Cell-free assay); ERK5 MEF2D (Cell-free assay) 0.82 μM; 3 μM

仕様

同義語
4-(2-Bromo-6-fluorobenzoyl)-N-(pyridin-3-yl)-1H-pyrrole-2-carboxamide
仕様と純度
≥98%
生化学的・生理学的メカニズム
ERK5-IN-2 is an orally active, sub-micromolar, selective ERK5 inhibitor with IC50 of 0.82 μM and 3 μM for ERK5 and ERK5 MEF2D, respectively.
保管条件
Protected from light,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%
製品の性質
ALogP
3.207
hba_count
3
HBD数
2
回転可能な結合
4
名前と識別子
パブケム・シド
504772899
パブケム・シド・ウル
https://pubchem.ncbi.nlm.nih.gov/substance/504772899
カノニカル・スマイル
C1=CC(=C(C(=C1)Br)C(=O)C2=CNC(=C2)C(=O)NC3=CN=CC=C3)F
IUPAC Name
4-(2-bromo-6-fluorobenzoyl)-N-pyridin-3-yl-1H-pyrrole-2-carboxamide
InChIKey
ATKCERYALDNMPL-UHFFFAOYSA-N
INCHI
1S/C17H11BrFN3O2/c18-12-4-1-5-13(19)15(12)16(23)10-7-14(21-8-10)17(24)22-11-3-2-6-20-9-11/h1-9,21H,(H,22,24)
異性体SMILES
C1=CC(=C(C(=C1)Br)C(=O)C2=CNC(=C2)C(=O)NC3=CN=CC=C3)F
分子量
388.19
Reaxy-Rn
29342528
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=29342528&ln=

ドキュメント

📋 安全データシート（SDS）

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<<<<<<< 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。

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📊 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
SuperclassOrganic oxygen compounds
分類Organooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones - Aryl ketones - Phenylketones
Direct ParentAryl-phenylketones
Alternative Parents Pyrrole carboxamides  Benzoyl derivatives  2-heteroaryl carboxamides  Fluorobenzenes  Bromobenzenes  Substituted pyrroles  Pyridines and derivatives  Aryl fluorides  Aryl bromides  Vinylogous halides  Vinylogous amides  Heteroaromatic compounds  Secondary carboxylic acid amides  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organofluorides  Organobromides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Aryl-phenylketone - 2-heteroaryl carboxamide - Pyrrole-2-carboxylic acid or derivatives - Pyrrole-2-carboxamide - Benzoyl - Halobenzene - Fluorobenzene - Bromobenzene - Benzenoid - Substituted pyrrole - Pyridine - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Aryl bromide - Heteroaromatic compound - Vinylogous amide - Vinylogous halide - Pyrrole - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound
説明This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl 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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EGFR Tclin Epidermal growth factor receptor erbB1 (33727 Activities)
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INSR Tclin Insulin receptor (5558 Activities)
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ERBB2 Tclin Receptor protein-tyrosine kinase erbB-2 (7851 Activities)
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PDGFRB Tclin Platelet-derived growth factor receptor beta (5195 Activities)
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IGF1R Tclin Insulin-like growth factor I receptor (8605 Activities)
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CSNK2A1 Tchem Casein kinase II alpha (3512 Activities)
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LCK Tclin Tyrosine-protein kinase LCK (9212 Activities)
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MAPK14 Tchem MAP kinase p38 alpha (12866 Activities)
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GSK3B Tclin Glycogen synthase kinase-3 beta (11785 Activities)
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CHEK2 Tchem Serine/threonine-protein kinase Chk2 (4015 Activities)
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PDPK1 Tchem 3-phosphoinositide dependent protein kinase-1 (3758 Activities)
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PRKAA2 Tchem AMP-activated protein kinase, alpha-2 subunit (1328 Activities)
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AKT2 Tchem Serine/threonine-protein kinase AKT2 (4301 Activities)
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CHUK Tchem Inhibitor of nuclear factor kappa B kinase alpha subunit (3170 Activities)
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IKBKB Tchem Inhibitor of nuclear factor kappa B kinase beta subunit (5554 Activities)
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DAPK2 Tchem Death-associated protein kinase 2 (740 Activities)
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AURKB Tchem Serine/threonine-protein kinase Aurora-B (6805 Activities)
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RPS6KA4 Tchem Ribosomal protein S6 kinase alpha 4 (2104 Activities)
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ROCK1 Tclin Rho-associated protein kinase 1 (4723 Activities)
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PIM1 Tchem Serine/threonine-protein kinase PIM1 (9629 Activities)
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PKN2 Tchem Protein kinase N2 (1991 Activities)
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CSK Tchem Tyrosine-protein kinase CSK (2395 Activities)
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RPS6KA5 Tchem Ribosomal protein S6 kinase alpha 5 (3355 Activities)
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PRKCE Tchem Protein kinase C epsilon (1520 Activities)
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PRKD3 Tchem Protein kinase C nu (2315 Activities)
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PRKCI Tchem Protein kinase C iota (2821 Activities)
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PIK3CA PI3-kinase p110-alpha subunit (51 Activities)
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Mapk1 MAP kinase ERK2 (650 Activities)
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Fgfr4 Fibroblast growth factor receptor 4 (138 Activities)
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Fgfr3 Fibroblast growth factor receptor 3 (21 Activities)
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Camk2g CaM kinase II gamma (1 Activities)
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Tec Tyrosine-protein kinase TEC (25 Activities)
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Mus musculus (284745 Activities)
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pknB Serine/threonine-protein kinase pknB (356 Activities)
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CDPK1 Calcium-dependent protein kinase 1 (793 Activities)
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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.

3 results found

Lot NumberCertificate Type日付商品
G2229265G2229265Certificate of AnalysisMay 12, 2025 E413634
G2229266G2229266Certificate of AnalysisMay 12, 2025 E413634
G2229267G2229267Certificate of AnalysisJun 15, 2022 E413634
化学的性質と物理的性質
溶解度Solubility (25°C) In vitro DMSO: 78 mg/mL (200.93 mM); Ethanol: 3 mg/mL (7.72 mM); Water: Insoluble;
感度Light sensitive
DMSO（mg / mL） 最大溶解度78
DMSO（mM） 最大溶解度200.932533037945
水（mg / mL） 最大溶解度＜1
分子量388.200 g/mol
XLogP32.900
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass387.002 Da
Monoisotopic Mass387.002 Da
Topological Polar Surface Area74.900 Ų
Heavy Atom Count24
Formal Charge0
Complexity479.000
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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