isopropyl-bis(2-chloroethyl)amine hydrochloride | 24426-36-6

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: isopropyl-bis(2-chloroethyl)amine hydrochloride
• 英文别名: bis-(2-chloro-ethyl)-isopropyl-amine; hydrochloride；Bis-(2-chlor-aethyl)-isopropyl-amin; Hydrochlorid；Bis-(2-chlor-aethyl)-isopropyl-ammonium-chlorid；isopropyl [bis(2-chloroethyl)]amine hydrochloride；N,N-bis(2-chloroethyl)propan-2-amine;hydrochloride
• CAS: 24426-36-6
• 化学式: C₇H₁₅Cl₂N*ClH
• 分子量: 220.57
• InChiKey: MRNUOMIAYMSZOS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.24
• 重原子数：
  11
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  4.4
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  isopropyl-bis(2-chloroethyl)amine hydrochloride 在 sodium hydroxide 、 草酰氯 、 18-冠醚-6 、 potassium carbonate 、 N,N-二甲基甲酰胺 作用下， 以 甲醇 、 二氯甲烷 、 丙酮 为溶剂， 反应 89.0h， 生成
  参考文献：
  名称：

  Synthesis and Structure−Activity Relationship of N-Substituted 4-Arylsulfonylpiperidine-4-hydroxamic Acids as Novel, Orally Active Matrix Metalloproteinase Inhibitors for the Treatment of Osteoarthritis

  摘要：

  The matrix metalloproteinases (MMPs) are a family of zinc-containing endopeptidases that play a key role in both physiological and pathological tissue degradation. In our preceding paper, we have reported on a series of novel and orally active N-hydroxy-alpha-phenylsulfonylacetamide derivatives. However, these compounds had two drawbacks (moderate selectivity and chirality issues). To circumvent these two problems, a series of novel and orally active N-substituted 4-benzenesulfonylpiperidine-4-carboxylic acid hydroxyamide derivatives have been synthesized. The present paper deals with the synthesis and SAR of these compounds. Among the several compounds synthesized, derivative 55 turned out to be a potent, selective, and an orally active MMP inhibitor in the clinically relevant advanced rabbit osteoarthritis model. Detailed pharmacokinetics and metabolism data are described.

  DOI：

  10.1021/jm0205550
• 作为产物：
  描述：

  2,2’-[(1-甲基乙基)亚氨基]二乙醇 在 氯化亚砜 、 氯仿 作用下， 生成 isopropyl-bis(2-chloroethyl)amine hydrochloride
  参考文献：
  名称：

  Hanby; Rydon, Journal of the Chemical Society, 1947, p. 517

  摘要：

  DOI：

文献信息

• Alkynyl containing hydroxamic acid compounds as matrix metalloproteinase/tace inhibitors
  申请人：American Cyanamid Company

  公开号：US06358980B1

  公开（公告）日：2002-03-19

  Compounds of the formula: useful in the treatment of arthritis, tumor metastasis, tissue ulceration, abnormal wound healing, periodontal disease, bone disease, diabetes (insulin resistance) and HIV infection.

  该式化合物有助于治疗关节炎、肿瘤转移、组织溃疡、异常伤口愈合、牙周病、骨病、糖尿病（胰岛素抵抗）和HIV感染。
• Alkynyl containing hydroxamic acid compounds as matrix metalloproteinase/TACE inhibitors
  申请人：WYETH

  公开号：US20040229924A1

  公开（公告）日：2004-11-18

  Compounds of the formula: 1 useful in the treatment of arthritis, tumor metastasis, tissue ulceration, abnormal wound healing, periodontal disease, bone disease, diabetes (insulin resistance) and HIV infection.

  该式的化合物：1在治疗关节炎、肿瘤转移、组织溃疡、异常伤口愈合、牙周病、骨病、糖尿病（胰岛素抵抗）和HIV感染方面有用。
• Terakawa; Tsujii, Yakugaku Zasshi/Journal of the Pharmaceutical Society of Japan, 1953, vol. 73, p. 1330,1332
  作者：Terakawa、Tsujii

  DOI：——

  日期：——
• GB901187
  申请人：——

  公开号：——

  公开（公告）日：——
• Hanby; Rydon, Journal of the Chemical Society, 1947, p. 517
  作者：Hanby、Rydon

  DOI：——

  日期：——