产品名称

英文名称：Ibrutinib (PCI-32765)

同义词

PCI32765、1-{(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl}prop-2-en-1-one、1-{(3R)-3-[4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1- yl}prop-2-en-1-one、AC-26942、BI164531、Ibrutinib- Bio-X、BDBM、依鲁替尼

产品性质

CAS编号：936563-96-1

分子式：C25H24N6O2

分子量：440.5

PubChem编号：24821094

别名：依鲁替尼

英文别名：PCI32765|1-{(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl}prop-2-en-1-one|1-{(3R)-3-[4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1- yl}prop-2-en-1-one|AC-26942|BI164531|Ibrutinib- Bio-X|BDBM

规格或纯度：≥98%

英文名称：Ibrutinib (PCI-32765)

生化机理：PCI-32765 is a high potent irreversible BTK inhibitor with an IC50 of 0.46 nM for the purified Btk.Highly potent, irreversible Bruton tyrosine kinase (BTK)\xa0inhibitor (IC 50 = 0.5nM). Inhibits autophosphorylation of BTK IC 50 = 11 nM), and phophorylation of PLCγ (IC 50 = 29 nM) and ERK (IC 50 = 13 nM).\xa0 Potently inhbits BLK, BMS, FGR, EGFR and ITK

储存温度：-20°C储存

运输条件：超低温冰袋运输

备注：10mg、50mg卖完停产，不再备货；有毒，请参阅SDS以获取更多信息。需要更多关于溶解度，用法和处理的建议吗？请访问我们的常见问题（FAQ）页面以获取更多详细信息。

产品介绍：Ibrutinib (PCI-32765)是一种有效的，高选择性的Btk抑制剂，IC50为0.5 nM，作用于Bmx， CSK， FGR， BRK及HCK，适度有效，对EGFR， Yes， ErbB2， JAK3等作用效果稍弱。Ibrutinib is a potent and highly selective Brutons tyrosine kinase (Btk) inhibitor with IC50 of 0.5 nM, modestly potent to Bmx, CSK, FGR, BRK, HCK, less potent to EGFR, Yes, ErbB2, JAK3, etc.

ALogP：3.6

IUPAC Name：1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one

INCHI：InChI=1S/C25H24N6O2/c1-2-21(32)30-14-6-7-18(15-30)31-25-22(24(26)27-16-28-25)23(29-31)17-10-12-20(13-11-17)33-19-8-4-3-5-9-19/h2-5,8-13,16,18H,1,6-7,14-15H2,(H2,26,27,28)/t18-/m1/s1

InChi Key：XYFPWWZEPKGCCK-GOSISDBHSA-N

Canonical SMILES：C=CC(=O)N1CCCC(C1)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N

Isomeric SMILES：C=CC(=O)N1CCC[C@H](C1)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N

PubChem CID：24821094

CAS Registry No.：936563-96-1

ChEMBL Ligand：CHEMBL1873475

Wikipedia：Ibrutinib

RCSB PDB Ligand：1E8

PEP：ibrutinib

Reactome Reaction：R-HSA-9679028

Reactome Drug：R-ALL-9678901

DrugCentral Ligand：4810

溶解性：DMSO ≥85mg/mL Water <1.2mg/mL Ethanol ≥1.8mg/mL

象形图：

信号词：Danger

危险声明：H315 Causes skin irritationH319 Causes serious eye irritationH335 May cause respiratory irritationH351 Suspected of causing cancerH373 Causes damage to organs through prolonged or repeated exposureH302 Harmful if swallowedH410 Very toxic to aquatic life with long lasting effectsH360 May damage fertility or the unborn child

预防措施声明：P261,P305+P351+P338,P273,P280,P302+P352,P321,P405,P501,P264,P260,P271,P270,P304+P340,P403+P233,P362+P364,P391,P330,P203,P264+P265,P301+P317,P318,P337+P317,P332+P317,P319

产品包装