N-(3-aminopropyl)-2,2-diphenylacetamide

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: N-(3-aminopropyl)-2,2-diphenylacetamide
• 英文别名: N-(3-Amino-propyl)-2,2-diphenyl-acetamide
• 化学式: C₁₇H₂₀N₂O
• 分子量: 268.359
• InChiKey: IPSKTULHAWOUBS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  20
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  55.1
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  N-(3-aminopropyl)-2,2-diphenylacetamide 在 三氯氧磷 作用下， 以 乙醇 、 甲苯 、 乙腈 为溶剂， 生成 4-chloro-N-[3-[(2,2-diphenylacetyl)amino]propyl]quinazoline-2-carboxamide
  参考文献：
  名称：

  一种增强TRPV4-KCa2.3复合体耦联度的化 合物及其在抗高血压中的应用

  摘要：

  本申请人提供了一种增强内皮细胞离子通道复合体TRPV4‑KCa2.3空间耦联度的化合物及其在抗高血压中的应用。本发明通过寻找内皮细胞离子通道复合体TRPV4‑KCa2.3的相互作用位点的结构域，制备了能同时作用于这两个作用位点的特异性化合物，发现该化合物能增强TRPV4‑KCa2.3复合体的空间耦联度，并对高血压药物的研发具有重大的意义。

  公开号：

  CN107056715B
• 作为产物：
  描述：

  3-Diphenyl-acetamino-propionitril 在 镍 氨 、 氢气 作用下， 以 甲醇 为溶剂， 生成 N-(3-aminopropyl)-2,2-diphenylacetamide
  参考文献：
  名称：

  A Structure−Activity Relationship Study of Novel Phenylacetamides Which Are Sodium Channel Blockers

  摘要：

  A structure-activity relationship study of a series of novel Na+ channel blockers, structurally related to N-[3-(2,6-dimethyl-1-piperidinyl)propyl]-alpha-phenylbenzeneacetamide (1, PD85639) is described. The diphenylacetic acid portion of the molecule was left unchanged throughout the study, while structural features in the amine portion and the amide alkyl linkage of the molecule were modified. The compounds were tested for inhibition of veratridine-stimulated Na+ influx in CHO cells expressing type IIA Na+ channels. Several derivatives show a trend toward more potent Na+ channel blockade activity with increasing lipophilicity of the amine portion of the molecule. The presence of a phenyl ring near the amine increases inhibitory potency. A three-carbon spacer between the amide and amine is optimal, and a secondary amide linkage is preferred.

  DOI：

  10.1021/jm950467y

文献信息

• COMPOUND FOR ENHANCING COUPLING OF TRPV4-KCA2.3 COMPLEX AND ANTIHYPERTENSIVE APPLICATIONS OF COMPOUND
  申请人：Jiangnan University

  公开号：EP3556747A1

  公开（公告）日：2019-10-23

  The applicant provides a compound for enhancing the space coupling degree of an endothelial cell ion channel complex TRPV4- KCa2.3 and anti-hypertension applications thereof. By finding the structural domains of the interacting sites of the endothelial cell ion channel complex TRPV4-KCa2.3, a compound with specificity which can act at the two interacting sites is prepared in the present invention. It is found that the compound can enhance the space coupling degree of the TRPV4-KCa2.3 complex and has great significance for the research and development of anti-hypertension drugs.

  申请人提供了一种提高内皮细胞离子通道复合物 TRPV4- KCa2.3 空间耦合度的化合物及其抗高血压应用。本发明通过寻找内皮细胞离子通道复合物 TRPV4-KCa2.3 的相互作用位点的结构域，制备出一种可作用于两个相互作用位点的具有特异性的化合物。研究发现，该化合物能增强TRPV4-KCa2.3复合物的空间偶联度，对抗高血压药物的研发具有重要意义。
• Compound for enhancing the coupling degree of complex TRPV4-KCa2.3 and anti-hypertension applications thereof
  申请人：Jiangnan University

  公开号：US10336712B2

  公开（公告）日：2019-07-02

  The applicant provides a compound for enhancing the space coupling degree of an endothelial cell ion channel complex TRPV4-KCa2.3 and anti-hypertension applications thereof. By finding the structural domains of the interacting sites of the endothelial cell ion channel complex TRPV4-KCa2.3, a compound with specificity which can act at the two interacting sites is prepared in the present invention. It is found that the compound can enhance the space coupling degree of the TRPV4-KCa2.3 complex and has great significance for the research and development of anti-hypertension drugs.

  申请人提供了一种提高内皮细胞离子通道复合物 TRPV4-KCa2.3 空间耦合度的化合物及其抗高血压应用。本发明通过寻找内皮细胞离子通道复合物 TRPV4-KCa2.3 的相互作用位点的结构域，制备了一种可作用于两个相互作用位点的具有特异性的化合物。研究发现，该化合物能增强TRPV4-KCa2.3复合物的空间偶联度，对抗高血压药物的研发具有重要意义。
• COMPOUND FOR ENHANCING THE COUPLING DEGREE OF COMPLEX TRPV4-KCA2.3 ^AND ANTI-HYPERTENSION APPLICATIONS THEREOF
  申请人：Jiangnan University

  公开号：EP3556747B1

  公开（公告）日：2020-08-26
• Compound for Enhancing the Coupling Degree of Complex TRPV4- KCa2.3 and Anti-hypertension Applications thereof
  申请人：Jiangnan University

  公开号：US20190077769A1

  公开（公告）日：2019-03-14

  The applicant provides a compound for enhancing the space coupling degree of an endothelial cell ion channel complex TRPV4-KCa2.3 and anti-hypertension applications thereof. By finding the structural domains of the interacting sites of the endothelial cell ion channel complex TRPV4-KCa2.3, a compound with specificity which can act at the two interacting sites is prepared in the present invention. It is found that the compound can enhance the space coupling degree of the TRPV4-KCa2.3 complex and has great significance for the research and development of anti-hypertension drugs.
• A Structure−Activity Relationship Study of Novel Phenylacetamides Which Are Sodium Channel Blockers
  作者：Ioannis Roufos、Sheryl Hays、Roy D. Schwarz

  DOI：10.1021/jm950467y

  日期：1996.1.1

  A structure-activity relationship study of a series of novel Na+ channel blockers, structurally related to N-[3-(2,6-dimethyl-1-piperidinyl)propyl]-alpha-phenylbenzeneacetamide (1, PD85639) is described. The diphenylacetic acid portion of the molecule was left unchanged throughout the study, while structural features in the amine portion and the amide alkyl linkage of the molecule were modified. The compounds were tested for inhibition of veratridine-stimulated Na+ influx in CHO cells expressing type IIA Na+ channels. Several derivatives show a trend toward more potent Na+ channel blockade activity with increasing lipophilicity of the amine portion of the molecule. The presence of a phenyl ring near the amine increases inhibitory potency. A three-carbon spacer between the amide and amine is optimal, and a secondary amide linkage is preferred.