2,4-difluoro-5-iodo-benzaldehyde | 1097626-30-6

• 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: 2,4-difluoro-5-iodo-benzaldehyde
• 英文别名: 2,4-Difluoro-5-iodobenzaldehyde
• CAS: 1097626-30-6
• 化学式: C₇H₃F₂IO
• 分子量: 268.002
• InChiKey: CBEJHLGWSDCCBL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  3

文献信息

• STABLE CRYSTAL OF 4-OXOQUINOLINE COMPOUND
  申请人：SATOH MOTOHIDE

  公开号：US20100204271A1

  公开（公告）日：2010-08-12

  Provision of a stabilized crystal of 6-(3-chloro-2-fluorobenzyl)-1-[(S)-1-hydroxymethyl-2-methylpropyl]-7-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid (compound A). A crystal of compound A, which shows a particular X-ray powder diffraction pattern of a characteristic diffraction peaks at diffraction angles 2θ(°) as measured by X-ray powder diffractometry.

  提供稳定的晶体化合物A，其化学式为6-(3-氯-2-氟苯基)-1-[(S)-1-羟甲基-2-甲基丙基]-7-甲氧基-4-氧代-1,4-二氢喹啉-3-羧酸。该晶体呈现出特定的X射线粉末衍射图案，其特征衍射峰在衍射角度2θ(°)处，通过X射线粉末衍射测量得出。
• 4-oxoquinoline compound and use thereof as hiv integrase inhibitor
  申请人：Japan Tobacco Inc.

  公开号：EP2161258A2

  公开（公告）日：2010-03-10

  An anti-HIV agent containing, as an active ingredient, a 4-oxoquinoline compound represented by the following formula [I] wherein each symbol is as defined in the specification, or a pharmaceutically acceptable salt thereof. The compound of the present invention has HIV integrase inhibitory action and is useful as an anti-HIV agent for the prophylaxis or therapy of AIDS. Moreover, by a combined use with other anti-HIV agents such as protease inhibitors, reverse transcriptase inhibitors and the like, the compound can become a more effective anti-HIV agent. Since the compound has high inhibitory activity specific for integrases, it can provide a safe pharmaceutical agent with a fewer side effects for human.

  一种抗HIV剂，其包含一个由以下式[I]表示的4-氧喹啉化合物作为活性成分，其中每个符号如规范中所定义，或其药学上可接受的盐。本发明的化合物具有HIV整合酶抑制作用，并且可用作预防或治疗艾滋病的抗HIV剂。此外，与其他抗HIV剂（如蛋白酶抑制剂，逆转录酶抑制剂等）的联合使用，该化合物可以成为更有效的抗HIV剂。由于该化合物具有特异性高的整合酶抑制活性，因此可以提供一种具有更少副作用的安全药物。
• CHEMICAL COMPOUNDS
  申请人：Basarab Gregory Steven

  公开号：US20100261719A1

  公开（公告）日：2010-10-14

  In one aspect, the present invention relates to compounds of Formula (I) and to pharmaceutically acceptable salts thereof, wherein: n is 1 to 4; and R 3 in each occurrence is independently selected from —X—R 5 , —W—R 6 , —C(O)—N(R 3a )—S(O) 2 —R 3b , —C(R 3a )═N—R 3y , C(R 3a )═N—N(R 3a )—C(O)—R 3b , C(R 3a )═N—N(R 3a )—C(O) 2 —R 3b , —C(R 3a )═N—N(R 3y ) 2 , —C(R 3a )═N—N(R 3a )—C(O)—N(R 3y ) 2 , —C(NR 3a ) 2 )═N—R 3y , —C(N(R 3a ) 2 )═N—OR 3y , —C(N(R 3a ) 2 )═N—C(O)—R 3b , —C(N(R 3a ) 2 ═N—S(0) 2 —R 3b , —C(N(R 3a ) 2 )═N—CN, —N═C(R 3y ) 2 , —N(R 3a )—S(O) 2 —N(R 3y ) 2 , —N(R 3a )—N(R 3y 2 , —N(R 3a )—C(O)—N(R 3y ) 2 , —N(R 3a )—C(O)—N(R 3a )—S(O) 2 —R 3b , —N(R 3a )—C(R 3a )═N(R 3y ), —N(R 3a )—C(R 3a )═N—OR 3y , —N(R 3a )—C(R 3a )═N—C(O)—R 3b , —N(R 3a )—C(R 3a )═N—S(O) 2 R— 3b , —N(R 3a )—C(R 3a )═N—CN, —N(R 3a )—C(N(R 3a ) 2 )═N—R 3y , —N(R 3a )—C(N(R 3a ) 2 )═N—OR 3y , —N(R 3a )—C(N(R 3a ) 2 )═N—C(O)—R 3b , —N(R 3a )—C(N(R 3a ) 2 )—N—S(O) 2 —R 3b , —N(R 3a )—C(N(R 3a ) 2 )—N—CN, —O—C(O)—R 3 , and —Si(R 3b ) 3 ; to methods of using them to treat bacterial infections, and to methods for their preparation.

  在一方面，本发明涉及公式（I）的化合物及其药学上可接受的盐，其中：n为1到4；每次R3独立地选择自—X—R5，—W—R6，—C（O）—N（R3a）—S（O）2—R3b，—C（R3a）═N—R3y，C（R3a）═N—N（R3a）—C（O）—R3b，C（R3a）═N—N（R3a）—C（O）2—R3b，—C（R3a）═N—N（R3y）2，—C（R3a）═N—N（R3a）—C（O）—N（R3y）2，—C（NR3a）2）═N—R3y，—C（N（R3a）2）═N—OR3y，—C（N（R3a）2）═N—C（O）—R3b，—C（N（R3a）2═N—S（0）2—R3b，—C（N（R3a）2）═N—CN，—N═C（R3y）2，—N（R3a）—S（O）2—N（R3y）2，—N（R3a）—N（R3y2，—N（R3a）—C（O）—N（R3y）2，—N（R3a）—C（O）—N（R3a）—S（O）2—R3b，—N（R3a）—C（R3a）═N（R3y），—N（R3a）—C（R3a）═N—OR3y，—N（R3a）—C（R3a）═N—C（O）—R3b，—N（R3a）—C（R3a）═N—S（O）2R—3b，—N（R3a）—C（R3a）═N—CN，—N（R3a）—C（N（R3a）2）═N—R3y，—N（R3a）—C（N（R3a）2）═N—OR3y，—N（R3a）—C（N（R3a）2）═N—C（O）—R3b，—N（R3a）—C（N（R3a）2）—N—S（O）2—R3b，—N（R3a）—C（N（R3a）2）—N—CN，—O—C（O）—R3，和—Si（R3b）3；以及使用它们治疗细菌感染的方法和它们的制备方法。
• 6-(HETEROCYCLE-SUBSTITUTED BENZYL)-4-OXOQUINOLINE COMPOUND AND USE OF THE SAME AS HIV INTEGRASE INHIBITOR
  申请人：Japan Tobacco, Inc.

  公开号：EP2033954A1

  公开（公告）日：2009-03-11

  The present invention relates to a compound represented by the following formula [I] wherein each symbol is as defined in the specification, or a pharmaceutically acceptable salt thereof, or a solvate thereof, and a pharmaceutical composition, an anti-HIV agent and an HIV integrase inhibitor containing such compound. The compound of the present invention has an HIV integrase inhibitory activity, and is useful as an anti-HIV agent, or as an agent for the prophylaxis or treatment of AIDS. In addition, by the combined use with other anti-HIV agents such as a protease inhibitor, a reverse transcriptase inhibitor and the like, it can be a more effective anti-HIV agnet. Because it shows integrase-specific high inhibitory activity, the compound can be a pharmaceutical agent safe on human body, which causes only a fewer side effects.

  本发明涉及下式[I]所代表的化合物 其中各符号如说明书中所定义，或其药学上可接受的盐，或其溶液，以及含有这种化合物的药物组合物、抗HIV剂和HIV整合酶抑制剂。本发明的化合物具有抑制 HIV 整合酶的活性，可用作抗 HIV 制剂或预防或治疗艾滋病的制剂。此外，通过与蛋白酶抑制剂、逆转录酶抑制剂等其他抗艾滋病毒药物联合使用，它可以成为一种更有效的抗艾滋病毒agnet。由于该化合物对整合酶具有特异性的高抑制活性，因此是一种对人体安全的药剂，副作用较小。
• 4-Oxoquinoline compound and use thereof as HIV integrase inhibitor
  申请人：Japan Tobacco, Inc.

  公开号：EP2272516A2

  公开（公告）日：2011-01-12

  An anti-HIV agent containing, as an active ingredient, a 4-oxoquinoline compound represented by the following formula [I] wherein each symbol is as defined in the specification, or a pharmaceutically acceptable salt thereof. The compound of the present invention has HIV integrase inhibitory action and is useful as an anti-HIV agent for the prophylaxis or therapy of AIDS. Moreover, by a combined use with other anti-HIV agents such as protease inhibitors, reverse transcriptase inhibitors and the like, the compound can become a more effective anti-HIV agent. Since the compound has high inhibitory activity specific for integrases, it can provide a safe pharmaceutical agent with a fewer side effects for human.

  一种抗艾滋病毒制剂，其活性成分含有下式[I]代表的 4-氧代喹啉化合物 其中各符号如说明书中所定义，或其药学上可接受的盐。本发明的化合物具有抑制艾滋病毒整合酶的作用，可用作预防或治疗艾滋病的抗艾滋病毒药物。此外，通过与蛋白酶抑制剂、逆转录酶抑制剂等其他抗艾滋病毒药物联合使用，本发明化合物可以成为更有效的抗艾滋病毒药物。由于该化合物对整合酶具有较高的特异性抑制活性，因此可以为人类提供一种安全的、副作用较小的药物制剂。