1-benzyl-N-pentyl-1,4-dihydroquinolin-4-imine hydrochloride

• ChemBase编号: 154559
• 分子式: C21H25ClN2
• 平均质量: 340.8896
• 单一同位素质量: 340.17062649
• SMILES: CCCCC/N=c/1\ccn(c2c1cccc2)Cc1ccccc1.Cl
• Canonical SMILES: CCCCC/N=c/1\ccn(c2c1cccc2)Cc1ccccc1.Cl
• InChI: InChI=1S/C21H24N2.ClH/c1-2-3-9-15-22-20-14-16-23(17-18-10-5-4-6-11-18)21-13-8-7-12-19(20)21;/h4-8,10-14,16H,2-3,9,15,17H2,1H3;1H
• InChIKey: JIRISCAPZWLWCG-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 1-benzyl-N-pentyl-1,4-dihydroquinolin-4-imine hydrochloride
• IUPAC传统名: 1-benzyl-N-pentylquinolin-4-imine hydrochloride
• 别名: N-[1-(phenylmethyl)-4(1H)-quinolinylidene]-1-pentanamine hydrochloride; CP-339818

登记号

• CAS号: 478341-55-8
• MDL号: MFCD09878238
• PubChem SID: 162248697
• PubChem CID: 20761468

理论计算性质

• 质子受体: 2
• 质子供体: 0
• LogD (pH = 5.5): 2.103051
• LogD (pH = 7.4): 2.3086607
• Log P: 5.5151405
• 摩尔折射率: 99.2945 cm^3
• 极化性: 37.462925 Å^3
• 极化表面积: 15.6 Å^2
• 可自由旋转的化学键: 6
• 里宾斯基五规则: false

分子性质

理化性质

• 溶解度: DMSO: >10 mg/mL
• 外观: white to off-white powder

安全信息

• 德国WGK号: 3
• 保存温度: 2-8°C

产品相关信息

• 纯度: ≥98% (HPLC)
• Empirical Formula (Hill Notation): C21H24N2 · HCl

详细说明

Sigma Aldrich - C2499

Biochem/physiol Actions
CP-338818 blocks both Kv1.3 and Kv1.4. Kv1.3 is expressed in brain and in effector memory T (Tem) cells, and Kv1.4 is expressed in brain cells. Kv1.3 and Kv1.4 are members of the Shaker family of voltage-gated potassium channels. Both channels are involved in setting the membrane potential of neurons. In addition, Kv1.3 maintains the membrane potential for T memory cells and is up-regulated upon T cell activation, contributing to multiple immune processes and disorders. Blockers of Kv1.3 have long been sought for therapeutic benefit, and they are also valuable tools for studying the immune system. CP-339818 is valuable for immune system studies, where the absence of Kv1.4 makes it functionally selective for Kv1.3, and it has shown suppression of T cell activation. CP-339818 is also valuable for the study of Kv1.4 function.