2,3-dihydro-(2-phenylmethyl)-1H-benz[de]isoquinoline | 65448-54-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 2,3-dihydro-(2-phenylmethyl)-1H-benz[de]isoquinoline
• 英文别名: 2-Benzyl-2,3-dihydro-1H-benzisochinolin；2-benzyl-2,3-dihydro-1H-benz[de]isoquinoline；2-Benzyl-2,3-dihydro-1H-benz[de]isochinolin；2-Benzyl-1,3-dihydrobenzo[de]isoquinoline
• CAS: 65448-54-6
• 化学式: C₁₉H₁₇N
• 分子量: 259.351
• InChiKey: ZTEHLAYQQUWEHM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  20
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  3.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  2,3-dihydro-(2-phenylmethyl)-1H-benz[de]isoquinoline 在 N-氯代丁二酰亚胺 、 氯甲酸乙酯 、 三乙胺 作用下， 以 乙醚 、 二氯甲烷 、 二氯甲烷-D2 为溶剂， 反应 12.92h， 生成 3H-benzisoquinoline
  参考文献：
  名称：

  Synthesis, Characterization, and Coordination Chemistry of the 2-Azaphenalenyl Radical

  摘要：

  The 2-azaphenalenyl radical 2 has been synthesized and characterized by ESR spectroscopy. Variable-temperature ESR measurements were carried out on both the phenalenyl (1) and the 2-azaphenalenyl (2) radicals. The phenalenyl radical 1 has the known propensity to dimerize at temperatures below 20 C, but unexpectedly less so than originally reported. The first experimental measurement of bond dissociation enthalpy for the dimerization of the phenalenyl radical 1 was obtained in CCl4 (11.34 +/- 0.11 kcal/mol) and toluene (9.8 +/- 0.7 kcal/mol). The 2-azaphenalenyl radical 2 does not show a propensity to dimerize over the measurable temperature range (220-330 K), but does so in the presence of Cu(hfac)(2) (hfac = hexafluoroacetylacetonate). The latter complex was characterized by X-ray crystallography.

  DOI：

  10.1021/ja029236o
• 作为产物：
  描述：

  2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮 在 lithium aluminium tetrahydride 作用下， 以 乙醚 、 甲苯 为溶剂， 反应 22.0h， 生成 2,3-dihydro-(2-phenylmethyl)-1H-benz[de]isoquinoline
  参考文献：
  名称：

  Inhibitors of blood platelet aggregation. Activity of some 1H-benz[de]isoquinolinecarboximidamides on the in vivo blood platelet aggregation induced by collagen

  摘要：

  A series of 33 1H-benz[de]isoquinolinecarboximidamides has been prepared and tested in the rat after intraperitoneal (ip) and/or oral (po) administration for their ability to inhibit the in vivo blood platelet aggregation induced by collagen. In this aggregation test, a considerable number of active compounds were found. Fourteen compounds were active when administered in [0.2 (mmol/kg)/day], five of which also exhibited significant po activity. One compound was toxic after ip administration but was found to be active after po administration without apparent toxicity. It is thought that the solubility of the drug in water is an important factor for the resorption after oral administration and, hence, for its oral activity.

  DOI：

  10.1021/jm00348a020

文献信息

• New and Convenient Synthesis of 2-Substituted 2,3-Dihydro-1<i>H</i>-benz[<i>de</i>]isoquinolin-1-ones
  作者：Ryu Sato、Katsuyuki Oikawa、Takehiko Goto、Minoru Saito

  DOI：10.1246/bcsj.61.2238

  日期：1988.6

  Various 2-substituted 2,3-dihydro-1H-benz[de]isoquinolin-1-ones were obtained in high yields by chemoselective reduction of 2-substituted 1H-benz[de]isoquinoline-1,3(2H)-diones with sodium or zinc borohydride at room temperature.

  通过在室温下使用钠或锌氢化硼对2-取代的1H-benz[de]isoquinoline-1,3(2H)-二酮进行化学选择性还原，获得了多种2-取代的2,3-二氢-1H-benz[de]isoquinolin-1-酮，产率很高。
• Ried; Grabosch, Chemische Berichte, 1958, vol. 91, p. 2485,2495
  作者：Ried、Grabosch

  DOI：——

  日期：——
• SATO, RYU;OIKAWA, KATSUYUKI;GOTO, TAKEHIKO;SAITO, MINORU, BULL. CHEM. SOC. JAP., 61,(1988) N 6, 2238-2240
  作者：SATO, RYU、OIKAWA, KATSUYUKI、GOTO, TAKEHIKO、SAITO, MINORU

  DOI：——

  日期：——
• POTMISCHIL F.; ROEMER D., REV. ROUM. CHIM. <RRCH-AX>, 1977, 22, NO 9-10, 1375-1378
  作者：POTMISCHIL F.、 ROEMER D.

  DOI：——

  日期：——