2-Chloro-N-[(6-{[3-(4-methyl-1-piperazinyl)propyl]sulfonyl}-1,3-benzothiazol-2-yl)carbamoyl]-5-(4-morpholinyl)benzamide

• 常用名: 2-Chloro-N-[(6-{[3-(4-methyl-1-piperazinyl)propyl]sulfonyl}-1,3-benzothiazol-2-yl)carbamoyl]-5-(4-morpholinyl)benzamide
• 英文名: 2-Chloro-N-[(6-{[3-(4-methyl-1-piperazinyl)propyl]sulfonyl}-1,3-benzothiazol-2-yl)carbamoyl]-5-(4-morpholinyl)benzamide
• CAS号: 1143020-91-0
• 分子量: 621.171
• 密度: 1.4±0.1 g/cm3
• 沸点: N/A
• 分子式: C₂₇H₃₃ClN₆O₅S₂
• 熔点: N/A
• 闪点: N/A

用途

AZ-GHS-22是一种有效的非CNS渗透剂GHS-R1a反向激动剂(IC50=0.77 nM)[1]。

名称

• 英文名: 2-Chloro-N-[(6-{[3-(4-methyl-1-piperazinyl)propyl]sulfonyl}-1,3-benzothiazol-2-yl)carbamoyl]-5-(4-morpholinyl)benzamide

生物活性

• 描述: AZ-GHS-22是一种有效的非CNS渗透剂GHS-R1a反向激动剂(IC50=0.77 nM)[1]。
• 相关类别:
  研究领域 >> 代谢疾病
  信号通路 >> G 蛋白偶联受体/G 蛋白 >> GHSR
• 参考文献:

  [1]. McCoull W, et al. Identification, optimization, and pharmacology of acylurea GHS-R1a inverse agonists. J Med Chem. 2014;57(14):6128-6140.

物理化学性质

• 密度: 1.4±0.1 g/cm3
• 分子式: C₂₇H₃₃ClN₆O₅S₂
• 分子量: 621.171
• 精确质量: 620.164246
• LogP: 0.61
• InChIKey: XWFQFKFKWKWIEW-UHFFFAOYSA-N
• SMILES: CN1CCN(CCCS(=O)(=O)c2ccc3nc(NC(=O)NC(=O)c4cc(N5CCOCC5)ccc4Cl)sc3c2)CC1
• 折射率: 1.645

靶点实验

查看更多实验

实验名称：Reduction in free feeding level in po dosed C57Bl6j mouse free feeding model measured... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL3376383

实验名称：Reduction in free feeding level in po dosed C57Bl6j mouse free feeding model measured... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL3376384

实验名称：Reduction in free feeding level in po dosed C57Bl6j mouse free feeding model measured... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL3376385

实验名称：Displacement of [125I]human ghrelin from human GHS-R1a expressed in HEK cell membrane... 来源：ChEMBL 靶标：Growth hormone secretagogue receptor type 1 External Id：CHEMBL3373238

实验名称：Lipophilicity, logD of the compound 来源：ChEMBL 靶标：N/A External Id：CHEMBL3373239

实验名称：Agonist activity at human GHS-R1a expressed in Tango U2OS-GHS-R1a cells by FLIPR base... 来源：ChEMBL 靶标：Growth hormone secretagogue receptor type 1 External Id：CHEMBL3373237

实验名称：Apparent permeability in MDCK cells expressing MDR1 at 10 uM assessed as apical to ba... 来源：ChEMBL 靶标：MDCK External Id：CHEMBL3373242

实验名称：Efflux ratio in MDCK cells expressing MDR1 at 10 uM 来源：ChEMBL 靶标：MDCK External Id：CHEMBL3373243

实验名称：Inverse agonist activity at human GHS-R1a expressed in Tango U2OS-GHS-R1a cells by FL... 来源：ChEMBL 靶标：Growth hormone secretagogue receptor type 1 External Id：CHEMBL3373241

实验名称：Ratio of plasma concentration in C57Bl6j mouse free feeding model at 100 mg/kg, po af... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3375781

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英文别名

• 2-Chloro-N-[(6-{[3-(4-methyl-1-piperazinyl)propyl]sulfonyl}-1,3-benzothiazol-2-yl)carbamoyl]-5-(4-morpholinyl)benzamide