tert-butyl N-(2-chloro-5-iodopyridin-3-yl)carbamate | 524070-13-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: tert-butyl N-(2-chloro-5-iodopyridin-3-yl)carbamate
• CAS: 524070-13-1
• 化学式: C₁₀H₁₂ClIN₂O₂
• 分子量: 354.575
• InChiKey: ZXOAXZKYTAZZFB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  51.2
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  tert-butyl N-(2-chloro-5-iodopyridin-3-yl)carbamate 在 盐酸 、 sodium nitrite 作用下， 生成 (+/-)-5-azidoepibatidine
  参考文献：
  名称：

  5-Azidoepibatidine: an exceptionally potent photoaffinity ligand for neuronal α4β2 and α7 nicotinic acetylcholine receptors

  摘要：

  Racemic 5-azidoepibatidine [(+/-)-1] was synthesized via 5-aminoepibatidine as a candidate photoaffinity ligand with exceptionally high affinity at the mammalian neuronal nicotinic receptors (K-i values of 0.027 nM for alpha4beta2 and 9.7 nM for alpha7) and excellent photoreactivity. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(02)00936-8
• 作为产物：
  描述：

  2-氯-5-碘-3-硝基吡啶 在 tin(ll) chloride 作用下， 生成 tert-butyl N-(2-chloro-5-iodopyridin-3-yl)carbamate
  参考文献：
  名称：

  5-Azidoepibatidine: an exceptionally potent photoaffinity ligand for neuronal α4β2 and α7 nicotinic acetylcholine receptors

  摘要：

  Racemic 5-azidoepibatidine [(+/-)-1] was synthesized via 5-aminoepibatidine as a candidate photoaffinity ligand with exceptionally high affinity at the mammalian neuronal nicotinic receptors (K-i values of 0.027 nM for alpha4beta2 and 9.7 nM for alpha7) and excellent photoreactivity. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(02)00936-8

文献信息

• 5-Azidoepibatidine: an exceptionally potent photoaffinity ligand for neuronal α4β2 and α7 nicotinic acetylcholine receptors
  作者：Nanjing Zhang、Motohiro Tomizawa、John E Casida

  DOI：10.1016/s0960-894x(02)00936-8

  日期：2003.2

  Racemic 5-azidoepibatidine [(+/-)-1] was synthesized via 5-aminoepibatidine as a candidate photoaffinity ligand with exceptionally high affinity at the mammalian neuronal nicotinic receptors (K-i values of 0.027 nM for alpha4beta2 and 9.7 nM for alpha7) and excellent photoreactivity. (C) 2002 Elsevier Science Ltd. All rights reserved.