244767-67-7

• 常用中文名：Dapivirine
• 常用英文名：Dapivirine (TMC120)
• CAS号：244767-67-7
• 分子式：C₂₀H₁₉N₅
• 分子量：329.398
• 相关类别： 生物化工 抑制剂 微生物学(Microbiology) Reverse Transcriptase 抑制剂
• 发布时间：2018-11-30 11:07:03
• 更新时间：2024-01-02 22:57:30
• Dapivirine(TMC 120, TMC 120 R147681)是HIV非核苷逆转录酶抑制剂（NNRTI），IC50为24 nM，能抑制包括NNRTI抗性的各种HIV-1毒株。

名称

• 中文名: Dapivirine
• 英文名: 4-[[4-(2,4,6-trimethylanilino)pyrimidin-2-yl]amino]benzonitrile
• 英文别名: 4-{[4-(Mesitylamino)-2-pyrimidinyl]amino}benzonitrile; 4-({4-[(2,4,6-trimethylphenyl)amino]pyrimidin-2-yl}amino)benzenecarbonitrile; Dapivirine (TMC120); TMC120; Benzonitrile, 4-[[4-[(2,4,6-trimethylphenyl)amino]-2-pyrimidinyl]amino]-; R-147681; 4-[[4-[(2,4,6-trimethylphenyl)amino]-2-pyrimidinyl]amino]benzonitrile; UNII: TCN4MG2VXS; Dapivirine; 4-{[4-(Mesitylamino)pyrimidin-2-yl]amino}benzonitrile; UNII-TCN4MG2VXS; dapivirinum

物化性质

• 密度: 1.2±0.1 g/cm3
• 沸点: 557.9±60.0 °C at 760 mmHg
• 分子式: C₂₀H₁₉N₅
• 分子量: 329.398
• 闪点: 291.2±32.9 °C
• 精确质量: 329.164032
• PSA: 73.63000
• LogP: 3.98
• 蒸汽压: 0.0±1.5 mmHg at 25°C
• 折射率: 1.649
• 储存条件: -20°C

生物活性

• 描述: Dapivirine(TMC 120, TMC 120 R147681)是HIV非核苷逆转录酶抑制剂(NNRTI),IC50为24 nM,能抑制包括NNRTI抗性的各种HIV-1毒株。
• 相关类别:
  信号通路 >> 抗感染 >> HIV
  信号通路 >> 抗感染 >> 逆转录酶
  研究领域 >> 感染
• 参考文献:

  [1]. Van Herrewege Y, et al. In vitro evaluation of nonnucleoside reverse transcriptase inhibitors UC-781 and TMC120-R147681 as human immunodeficiency virus microbicides. Antimicrob Agents Chemother. 2004 Jan;48(1):337-9.

  [2]. Fletcher P, et al. Inhibition of human immunodeficiency virus type 1 infection by the candidate microbicide dapivirine, a nonnucleoside reverse transcriptase inhibitor. Antimicrob Agents Chemother. 2009 Feb;53(2):487-95.

  [3]. Di Fabio S, et al. Inhibition of vaginal transmission of HIV-1 in hu-SCID mice by the non-nucleoside reverse transcriptase inhibitor TMC120 in a gel formulation. AIDS. 2003 Jul 25;17(11):1597-604.

  [4]. Nel AM, et al. Pharmacokinetics of 2 dapivirine vaginal microbicide gels and their safety vs. Hydroxyethyl cellulose-based universal placebo gel. J Acquir Immune Defic Syndr. 2010 Oct;55(2):161-9.

安全

• 危害码 (欧洲): Xi

合成路线

873-74-5 ~% 244767-67-7

文献：Bioorganic and Medicinal Chemistry Letters, , vol. 23, # 18 p. 5213 - 5216

329187-59-9 ~% 244767-67-7

文献：Bioorganic and Medicinal Chemistry Letters, , vol. 23, # 18 p. 5213 - 5216

1452007-28-1 ~% 244767-67-7

文献：Bioorganic and Medicinal Chemistry Letters, , vol. 23, # 18 p. 5213 - 5216

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