Capmatinib hydrochloride anhydrous
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基本情報
- CAS
1197376-85-4- 標準SMILES
CNC(=O)c1ccc(-c2cnc3ncc(Cc4ccc5ncccc5c4)n3n2)cc1F.Cl.Cl- InChIKey
ZTNPHABKLIJXTL-UHFFFAOYSA-N- 分子式
- C23H19Cl2FN6O
- 平均分子量
- 485.3 g/mol
名称と識別子
- 優先名称
- Capmatinib hydrochloride anhydrous
- IUPAC
- 2-fluoro-N-methyl-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzamide;dihydrochloride
- 英語名
- INCB28060 Dihydrochloride
- 分子式
- C23H18ClFN6O
- 分子量
- 448.89
名称と別名
Capmatinib dihydrochloride1197376-85-4Z0V2EW20JRcapmatinib hydrochloride anhydrous2-fluoro-n-methyl-4-(7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl)benzamide dihydrochloride2-fluoro-n-methyl-4-(7-(quinolin-6-ylmethyl)imidazo(1,2-b)(1,2,4)triazin-2-yl)benzamide dihydrochlorideRefChem:200061Capmatinib 2HClCapmatinib (dihydrochloride)2-fluoro-N-methyl-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzamide;dihydrochloride2-Fluoro-N-methyl-4-[7-[(quinolin-6-yl)methyl]imidazo[1,2-b]-[1,2,4]triazin-2-yl]benzamide DihydrochlorideBenzamide, 2-fluoro-N-methyl-4-[7-(6-quinolinylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]-, hydrochloride (1:2)
名称をさらに表示
INCB28060 2HClINCB28060 DihydrochlorideCapmatinib 2HCl, 10 mM in DMSOCapmatinib,Apoptosis,c-Met/HGFR,INC 280,H441,INCB28060,INC280,orally active,Capmatinib 2HCl,INCB-28060,SNU-5,INC-280,Inhibitor,S114,INCB 28060,inhibit,U-87MG,ATP competitive,Balb/c nu/nu mice
UNII-Z0V2EW20JRC23H19Cl2FN6OINC-280 2HClorb1303013SCHEMBL1427109ZTNPHABKLIJXTL-UHFFFAOYSA-NHY-13404AMFCD30502991
データベース識別子
- CAS
1197376-85-4- PubChem CID
- 44513225
- UNII
- Z0V2EW20JR
- EC Number
- 695-736-8
物性
構造計算による物性補完中
- 極性表面積
- 85.1 Ų
- 水素結合供与体数
- 3
- 水素結合受容体数
- 6
- 回転可能結合数
- 4
- 重原子数
- 33
- 形式電荷
- 0
- 複雑度
- 637
物理化学的性質
- InChI
- InChI=1S/C23H17FN6O.ClH/c1-25-22(31)18-6-5-16(11-19(18)24)21-13-28-23-27-12-17(30(23)29-21)10-14-4-7-20-15(9-14)3-2-8-26-20;/h2-9,11-13H,10H2,1H3,(H,25,31);1H
- InChIKey
- JJBXRCLAAKZSNF-UHFFFAOYSA-N
- SMILES
- C(C1C=CC2N=CC=CC=2C=1)C1=CN=C2N=CC(C3C=CC(C(=O)NC)=C(F)C=3)=NN12.Cl
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Danger
H301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P308+P316, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Hazard Classes and CategoriesAcute Tox. 3 (33.3%)
安全データ
- 危険有害性情報
- コード 危険有害性情報 危険有害性クラス 区分 注意喚起語 シンボル P コード H371
化学と産業
応用分野
説明INCB28060 Dihydrochloride is a novel, ATP-competitive inhibitor of c-MET kinase with an IC50 with 0.13 nM.
使用INCB28060 dihydrochloride exhibits picomolar enzymatic potency and is highly specific for c-MET with more than 10, 000-fold selectivity over a large panel of human kinases. This inhibitor potently blocks c-MET phosphorylation and activation of its key downstream effectors in c-MET-dependent tumor cell lines. As a result, INCB 28060 potently inhibits c-MET-dependent tumor cell proliferation and migration and effectively induces apoptosis in vitro.
関連反応
4 件
化合物ノート
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