KRCA-0008

• 常用名: KRCA-0008
• 英文名: KRCA 0008
• CAS号: 1472795-20-2
• 分子量: 609.119
• 密度: 1.3±0.1 g/cm3
• 沸点: 870.2±75.0 °C at 760 mmHg
• 分子式: C₃₀H₃₇ClN₈O₄
• 熔点: N/A
• 闪点: 480.1±37.1 °C

KRCA-0008用途

KRCA-0008是一个高效选择性ALK/Ack1抑制剂，对ALK和Ack1的IC50值分别为12nM和4nM，具有非hERG依赖性药物特征。

KRCA-0008名称

• 中文名: KRCA-0008
• 英文名: 1,1'-{(5-Chloro-2,4-pyrimidinediyl)bis[imino(3-methoxy-4,1-phenylene)-4,1-piperazinediyl]}diethanone

KRCA-0008生物活性

• 描述: KRCA-0008是一个高效选择性ALK/Ack1抑制剂,对ALK和Ack1的IC50值分别为12nM和4nM,具有非hERG依赖性药物特征。
• 相关类别:
  信号通路 >> 蛋白酪氨酸激酶 >> ACK1
  信号通路 >> 蛋白酪氨酸激酶 >> ALK
  研究领域 >> 癌症
• 参考文献:

  [1]. Park CH, et al. Novel bis-ortho-alkoxy-para-piperazinesubstituted-2,4-dianilinopyrimidines (KRCA-0008) as potent and selective ALK inhibitors for anticancer treatment. Bioorg Med Chem Lett. 2013 Nov 15;23(22):6192-6.

KRCA-0008物理化学性质

• 密度: 1.3±0.1 g/cm3
• 沸点: 870.2±75.0 °C at 760 mmHg
• 分子式: C₃₀H₃₇ClN₈O₄
• 分子量: 609.119
• 闪点: 480.1±37.1 °C
• 精确质量: 608.262634
• LogP: 0.75
• InChIKey: TXDIRJCYNAWBOS-UHFFFAOYSA-N
• SMILES: COc1cc(N2CCN(C(C)=O)CC2)ccc1Nc1ncc(Cl)c(Nc2ccc(N3CCN(C(C)=O)CC3)cc2OC)n1
• 蒸汽压: 0.0±0.3 mmHg at 25°C
• 折射率: 1.643
• 储存条件: 2-8℃

KRCA-0008安全信息

• 危险品运输编码: NONH for all modes of transport

KRCA-0008靶点实验

查看更多实验

实验名称：Primary qHTS assay for small molecule inhibitors of Inositol hexaphosphate kinase 1 (... 来源：NCGC External Id：IP6K1-p1

实验名称：Cytochrome P450 family 3 subfamily A member 4 (CYP3A4) small molecule antagonists: lu... 来源：NCGC External Id：CYP3A4437

实验名称：Cellular viability qHTS for adrenocortical cancer (ACC) cell line SW-13 来源：NCGC 靶标：N/A External Id：ACC-ATC-p1-SW13-72hr

实验名称：Cytochrome P450 family 2 subfamily D member 6 (CYP2D6) small molecule antagonists: lu... 来源：NCGC External Id：CYP2D6395

实验名称：Cytochrome P450 family 2 subfamily C member 9 (CYP2C9) small molecule antagonists: lu... 来源：NCGC External Id：CYP2C9536

实验名称：Cellular viability qHTS for adrenocortical cancer (ACC) cell line NCI-H295R 来源：NCGC 靶标：N/A External Id：ACC-ATC-p1-H295R-72hr

实验名称：Cytotoxicity counterscreen for inhibitors of SARS-CoV-2 cell entry 来源：NCGC 靶标：N/A External Id：TRND-SARS-CoV-2-cytotox-48hr

实验名称：SARS-CoV-2 3CL-Pro protease inhibition percentage at 20µM by FRET kind of response f... 来源：ChEMBL 靶标：Replicase polyprotein 1ab External Id：CHEMBL4495582

实验名称：Primary qHTS to identify inhibitors of SARS-CoV-2 cell entry 来源：NCGC External Id：TRND-SARS-CoV-2-PP

实验名称：Cytochrome P450 family 3 subfamily A member 7 (CYP3A7) small molecule antagonists: lu... 来源：NCGC External Id：CYP3A7681

共39条，当前第1页，共4页

1

2

3

4

KRCA-0008英文别名

• 1,1'-{(5-Chloro-2,4-pyrimidinediyl)bis[imino(3-methoxy-4,1-phenylene)-4,1-piperazinediyl]}diethanone
• MFCD28133395
• KRCA-0008