5,6-二甲氧基-1-氨基茚满盐酸盐 | 83402-82-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 茚满类
• 中文名称: 5,6-二甲氧基-1-氨基茚满盐酸盐
• 英文名称: 1-amino-5,6-dimethoxyindane hydrochloride
• 英文别名: 5,6-dimethoxy-indan-1-ylamine; hydrochloride；5,6-Dimethoxy-2,3-dihydro-1H-inden-1-amine hydrochloride；5,6-dimethoxy-2,3-dihydro-1H-inden-1-amine;hydrochloride
• CAS: 83402-82-8
• 化学式: C₁₁H₁₅NO₂*ClH
• 分子量: 229.707
• InChiKey: YULANTAURATVCM-UHFFFAOYSA-N

物化性质

• 熔点：
  249-250 °C

计算性质

• 辛醇/水分配系数(LogP)：
  2.07
• 重原子数：
  15
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  44.5
• 氢给体数：
  2
• 氢受体数：
  3

安全信息

• 海关编码：
  2922199090

反应信息

• 作为反应物：
  描述：

  5,6-二甲氧基-1-氨基茚满盐酸盐 、 甲基磺酰氯 在 sodium hydroxide 、 三乙胺 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 反应 18.0h， 以80%的产率得到N-(5,6-dimethoxyindane-1-yl)methanesulfonamide
  参考文献：
  名称：

  Carbonic anhydrase inhibitory properties of novel sulfonamide derivatives of aminoindanes and aminotetralins

  摘要：

  Six sulfonamides derived from indanes and tetralines were synthesized. The human carbonic anhydrase isozymes hCA I and hCA II inhibition effects of the synthesized sulfonamides were determined. From these compounds, while N-(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl) methane sulfonamide showed the most potent inhibitory effect against hCA I (K-i = 46 +/- 5.4 mu M, r(2) = 0.978), N-(1,2,3,4-tetrahydronaphthalene-2-yl) methanesulfonamide was found to have the best inhibitory effect against hCA II (K-i = 94 +/- 7.6 mu M, r(2) = 0.982).

  DOI：

  10.3109/14756366.2012.750311
• 作为产物：
  描述：

  5,6-dimethoxy-1-indanol 在 叠氮磷酸二苯酯 、 palladium on activated charcoal 、 氢气 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 四氢呋喃 、 甲醇 、 氯仿 为溶剂， 反应 34.0h， 生成 5,6-二甲氧基-1-氨基茚满盐酸盐
  参考文献：
  名称：

  Carbonic anhydrase inhibitory properties of novel sulfonamide derivatives of aminoindanes and aminotetralins

  摘要：

  Six sulfonamides derived from indanes and tetralines were synthesized. The human carbonic anhydrase isozymes hCA I and hCA II inhibition effects of the synthesized sulfonamides were determined. From these compounds, while N-(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl) methane sulfonamide showed the most potent inhibitory effect against hCA I (K-i = 46 +/- 5.4 mu M, r(2) = 0.978), N-(1,2,3,4-tetrahydronaphthalene-2-yl) methanesulfonamide was found to have the best inhibitory effect against hCA II (K-i = 94 +/- 7.6 mu M, r(2) = 0.982).

  DOI：

  10.3109/14756366.2012.750311

文献信息

• BENZIMIDAZOLYL-METHYL UREA DERIVATIVES AS ALX RECEPTOR AGONISTS
  申请人：ACTELION PHARMACEUTICALS LTD

  公开号：US20160200686A1

  公开（公告）日：2016-07-14

  The present invention relates to benzimidazolyl-methyl urea derivatives of formula (I), wherein n, D, E, R 1 , R 2 , R 3 , R 4 , R 6 , R 7 , R 8 and R 9 are as defined in the description, their preparation and their use as pharmaceutically active compounds.

  本发明涉及公式（I）的苯并咪唑基甲基脲衍生物，其中n，D，E，R1，R2，R3，R4，R6，R7，R8和R9如说明书所定义，它们的制备以及它们作为药物活性化合物的用途。
• US9663473B2
  申请人：——

  公开号：US9663473B2

  公开（公告）日：2017-05-30
• Carbonic anhydrase inhibitory properties of novel sulfonamide derivatives of aminoindanes and aminotetralins
  作者：Yusuf Akbaba、Akın Akıncıoğlu、Hülya Göçer、Süleyman Göksu、İlhami Gülçin、Claudiu T. Supuran

  DOI：10.3109/14756366.2012.750311

  日期：2014.2.1

  Six sulfonamides derived from indanes and tetralines were synthesized. The human carbonic anhydrase isozymes hCA I and hCA II inhibition effects of the synthesized sulfonamides were determined. From these compounds, while N-(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl) methane sulfonamide showed the most potent inhibitory effect against hCA I (K-i = 46 +/- 5.4 mu M, r(2) = 0.978), N-(1,2,3,4-tetrahydronaphthalene-2-yl) methanesulfonamide was found to have the best inhibitory effect against hCA II (K-i = 94 +/- 7.6 mu M, r(2) = 0.982).