3,5-bis((tert-butyldimethylsilyl)oxy)aniline | 1398702-11-8

• 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: 3,5-bis((tert-butyldimethylsilyl)oxy)aniline
• 英文别名: 3,5-Bis[[tert-butyl(dimethyl)silyl]oxy]aniline
• CAS: 1398702-11-8
• 化学式: C₁₈H₃₅NO₂Si₂
• 分子量: 353.652
• InChiKey: SUBDSNMSVKJERE-UHFFFAOYSA-N

物化性质

• 沸点：
  373.6±37.0 °C(Predicted)
• 密度：
  0.939±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  6.04
• 重原子数：
  23
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  44.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3,5-bis((tert-butyldimethylsilyl)oxy)aniline 在 四丁基氟化铵 、 1-羟基苯并三唑 、 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 、 三乙胺 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 1.0h， 生成
  参考文献：
  名称：

  一类烷基酚类化合物及其制备方法

  摘要：

  本发明提供了一类烷基酚类化合物及其制备方法，具体地，本发明提供了一种如化学式I表示的新型烷基多酚类化合物，其制备方法以及所述化合物在治疗代谢综合症上的用途。

  公开号：

  CN115322077A
• 作为产物：
  描述：

  间苯三酚 在 咪唑 、 ammonium hydroxide 作用下， 以 四氢呋喃 、 水 为溶剂， 反应 61.0h， 生成 3,5-bis((tert-butyldimethylsilyl)oxy)aniline
  参考文献：
  名称：

  SUBSTITUTED AROMATIC COMPOUND, HYDROGELATION AGENT, HYDROGEL, AND METHOD FOR GELATING AQUEOUS SAMPLE

  摘要：

  公开号：

  EP2684868B1

文献信息

• Photoresponsive self-assembled hexameric capsules based on calix[4]resorcinarenes bearing azobenzene dendron conjugates as side chains
  作者：Tsubasa Sakano、Toshifumi Ohashi、Masamichi Yamanaka、Kenji Kobayashi

  DOI：10.1039/c5ob00997a

  日期：——

  We synthesized calix[4]resorcinarenes bearing various azobenzene dendron conjugates as side chains, wherein the azobenzene moiety is a photoresponsive unit and the dendron moiety is a capsule-destabilizing unit, and then studied the photoresponsive properties of their self-assembled hexameric capsules in conjunction with guest encapsulation in H2O-saturated CDCl3. It was found that correlation between

  我们合成了带有各种偶氮苯树枝状共轭物作为侧链的杯[4]间苯二酚芳烃，其中偶氮苯部分是光响应单元，树枝状部分是胶囊失稳单元，然后结合它们研究了自组装六聚体胶囊的光响应特性与客体封装在H 2 O饱和的CDCl 3中。它被发现之间的相关反式-到-顺主机的偶氮苯树枝状侧链的光致异构化和随之而来的胶囊不稳定导致来宾释放在很大程度上取决于树枝状部分的性质，例如其空间的蓬松度和亲水性。
• Formation of pH-Responsive Supramolecular Hydrogels in Basic Buffers: Self-assembly of Amphiphilic Tris-Urea
  作者：Shinya Kimura、Nana Haraya、Tomoki Komiyama、Masashi Yokoya、Masamichi Yamanaka

  DOI：10.1248/cpb.c21-00539

  日期：2021.11.1

  this range. When the borate–NaOH buffer was used, supramolecular hydrogels were formed over a wide pH range (7.5–11.0). The thermal stabilities and viscoelastic properties of the supramolecular hydrogels were determined from the gel-to-sol phase transition temperatures and rheological properties, respectively. The supramolecular hydrogel formed from compound 1 and the borate–NaOH buffer exhibited a

  设计并合成了一种含有亲水性间苯二酚单元的两亲性三脲化合物( 1 )。化合物1在碱性缓冲液中形成超分子水凝胶，如甘氨酸-NaOH、磷酸盐-NaOH、4-(2-羟乙基)-1-哌嗪乙磺酸 (HEPES)-NaOH 和硼酸盐-NaOH。用于凝胶化的缓冲溶液的最佳 pH 值范围为 10-11，当 pH 值超出此范围时，会形成不溶性悬浮液或溶液。当使用硼酸盐-NaOH 缓冲液时，超分子水凝胶在很宽的 pH 范围（7.5-11.0）内形成。超分子水凝胶的热稳定性和粘弹性分别由凝胶到溶胶的相变温度和流变特性确定。由化合物形成的超分子水凝胶1和硼酸盐-NaOH缓冲液表现出pH响应的可逆凝胶-溶胶相变特性。加入NaOH可以实现凝胶到溶胶的相变，加入适量的硼酸实现溶胶的再凝胶化。增加酸的量导致凝胶-溶胶相变。 全尺寸图像
• Synthesis, evaluation and molecular modelling of piceatannol analogues as arginase inhibitors
  作者：J. Muller、B. Cardey、A. Zedet、C. Desingle、M. Grzybowski、P. Pomper、S. Foley、D. Harakat、C. Ramseyer、C. Girard、M. Pudlo

  DOI：10.1039/d0md00011f

  日期：——

  A quantum chemistry guided optimisation (leading to piceatannol analogue3t) with a good understanding of the catechol binding mode to the bimanganese cluster of arginase.

  通过对辅酶A双锰酶的邻苯二酚结合模式有很好的理解，进行了量子化学引导的优化（导致了对应皮色丹醇类似物3t）。
• Design, synthesis, biological and structural evaluation of functionalized resveratrol analogues as inhibitors of quinone reductase 2
  作者：Sarah E. St. John、Katherine C. Jensen、SooSung Kang、Yafang Chen、Barbara Calamini、Andrew D. Mesecar、Mark A. Lipton

  DOI：10.1016/j.bmc.2013.07.037

  日期：2013.10

  Resveratrol (3,5,4'-trihydroxylstilbene) has been proposed to elicit a variety of positive health effects including protection against cancer and cardiovascular disease. The highest affinity target of resveratrol identified so far is the oxidoreductase enzyme quinone reductase 2 (QR2), which is believed to function in metabolic reduction and detoxification processes; however, evidence exists linking QR2 to the metabolic activation of quinones, which can lead to cell toxicity. Therefore, inhibition of QR2 by resveratrol may protect cells against reactive intermediates and eventually cancer. With the aim of identifying novel inhibitors of QR2, we designed, synthesized, and tested two generations of resveratrol analogue libraries for inhibition of QR2. In addition, Xray crystal structures of six of the resveratrol analogues in the active site of QR2 were determined. Several novel inhibitors of QR2 were successfully identified as well as a compound that inhibits QR2 with a novel binding orientation. (c) 2013 Elsevier Ltd. All rights reserved.