1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン

化学名:1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン

CAS番号.172889-27-9

英語名:PP2

CBNumberCB1406580

MFC15H16ClN5

MW301.77

MOL File172889-27-9.mol

别名

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン

PP2

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン物理性質

沸点	493.5±40.0 °C(Predicted)
比重(密度)	1.35±0.1 g/cm3(Predicted)
貯蔵温度	2-8°C
溶解性	DMSO (最大 25mg/ml) またはエタノール (加熱すると最大 3mg/ml) に可溶。
酸解離定数(Pka)	3.96±0.30(Predicted)
外見	オフホワイトの無地
色	オフホワイト
安定性：	購入日から2年間安定です。この DMSO またはエタノール溶液は、-20°C で 1 か月間保存できます。
InChI	InChI=1S/C15H16ClN5/c1-15(2,3)21-14-11(13(17)18-8-19-14)12(20-21)9-4-6-10(16)7-5-9/h4-8H,1-3H3,(H2,17,18,19)
InChIKey	PBBRWFOVCUAONR-UHFFFAOYSA-N
SMILES	C1=NC(N)=C2C(C3=CC=C(Cl)C=C3)=NN(C(C)(C)C)C2=N1

安全性情報

主な危険性	T
Rフレーズ	25
Sフレーズ	45
RIDADR	UN 2811 6.1 / PGIII
ストレージクラス	6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects
Hazard Classifications	Acute Tox. 3 Oral

危険有害性情報のコード(GHS)

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン価格

製品番号	包装	価格	製品説明	購入
富士フイルム和光純薬株式会社(wako) W01BVI1767-5	5mg	￥100100		購入
富士フイルム和光純薬株式会社(wako) W01BVI1767-1	1mg	￥26000		購入
富士フイルム和光純薬株式会社(wako) W01TOC1407	10mg	￥101000	PP2	購入
富士フイルム和光純薬株式会社(wako) W01MAS096440	250mg	￥1043300	1-(tert-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-d]ピリミジン-4-アミン	購入
富士フイルム和光純薬株式会社(wako) W01MAS096440	1g	￥2318400	1-(tert-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-d]ピリミジン-4-アミン	購入

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン化学特性,用途語,生産方法

外観
結晶～粉末
溶解性
メタノール､DMSOに溶ける。
用途
チロシンキナーゼの研究。
説明
The Src family of non-receptor tyrosine kinases regulate cell adhesion, growth, and differentiation through activation of multiple intracellular signaling pathways. Normally inactive, Src kinases are transiently activated during mitosis and constitutively activated by abnormal mutations. PP2 is a potent, reversible, ATP-competitive, and selective inhibitor of the Src family of protein tyrosine kinases. It inhibits p56^lck(IC₅₀ = 4 nM), p59^fynT (IC₅₀ = 5 nM), Hck (IC₅₀ = 5 nM), and Src (IC₅₀ = 100 nM). PP2 does not significantly affect the activity of EGFR kinase (IC₅₀ = 480 nM), JAK2 (IC₅₀ > 50 μM), or ZAP-70 (IC₅₀ > 100 μM). PP2 inhibits the activation of focal adhesion kinase as well as its phosphorylation at Tyr⁵⁷⁷. PP2 also inhibits anti-CD3-stimulated tyrosine phosphorylation of human T-cells with an IC₅₀ value of 600 nM.
使用
PP2 has been used:
- to analyze the effects of Src/focal adhesion kinase (FAK) signaling on IQ domain GTPase-activating protein 1 (IQGAP1)-mediated anoikis resistance
- for Src inhibition to study its effect on epidermal growth factor receptor (EGFR) and nuclear factor erythroid 2-related factor 2 (Nrf2) phosphorylation in non-small cell lung cancer (NSCLC) cells
- for pharmacological inhibition of SRC in MDA-MB-231 breast cancer cells
生物活性
Selective inhibitor of Src-family tyrosine kinases. Inhibits p56 lck and p59 fynT (IC 50 values are 4 and 5 nM respectively). Displays > 10000-fold selectivity over ZAP-70 and JAK2. Moderately inhibits CSK (IC 50 = 0.73 μ M).
酵素阻害剤
This cell-permeable and photosensitive ATP site-directed pyrazolepyrimidine (FW = 301.78 g/mol), also known as 4-amino-5-(4- chlorophenyl)-7-(t-butyl)pyrazolo[3,4-d]pyrimidine and tyrphostin AG 1879, potently inhibits Lck and Fyn protein kinases, with IC50 values of 4 nM and 5 nM. PP2 is ~100x less potent toward EGFR and is inactive for ZAP-70, JAK2 and PKA. PP2 prevented serum-independent growth of RET/PTC1-transformed NIH3T3 fibroblasts and of TPC1 and FB2, two human papillary thyroid carcinoma cell lines that carry spontaneous RET/PTC1 rearrangements. PP2 activates the E-cadherin-mediated cell adhesion system, suppressing metastasis in cancer cells. In cervical cancer cells (HeLa and SiHa), 10 μM PP2 down-regulates pSrc-Y416, pEGFR-Y845, and pEGFR-Y1173 expression levels, while downregulatING pSrc-Y416 and pEGFR-Y845, but not pEGFR-Y1173. PP2 is also a potential neuroprotective agent in cerebral ischemia-reperfusion. Target(s): casein kinase 1d, IC50 = 1.3 μM; Csk protein-tyrosine kinase; focal adhesion kinase; lymphocyte kinase, IC50 = 0.06 μM; p56lck, IC50 = 4 nM; p59fynT, IC50 = 5 nM; receptor proteintyrosine kinase; src protein-tyrosine kinase, IC50 = 0.7 μM (5,11,12- 23); stress-activated protein kinase 2a/p38, IC50 = 1.4 μM; and Yes kinase.

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン生産企業

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミンスペクトルデータ(¹HNMR)

172889-27-9, 1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミンキーワード

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1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン

危険有害性情報のコード(GHS)

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン 価格

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン 化学特性,用途語,生産方法

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン 生産企業

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン スペクトルデータ(1HNMR)

172889-27-9, 1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン キーワード

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン価格

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン化学特性,用途語,生産方法

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミン生産企業

1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミンスペクトルデータ(¹HNMR)

172889-27-9, 1-(TERT-ブチル)-3-(4-クロロフェニル)-1H-ピラゾロ[3,4-D]ピリミジン-4-アミンキーワード