2-(4-chlorophenyl)-5-aminobenzimidazole hydrochloride | 817172-30-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 2-(4-chlorophenyl)-5-aminobenzimidazole hydrochloride
• 英文别名: 2-(4-Chlorophenyl)-1H-benzoimidazol-5-ylamine hydrochloride；2-(4-chlorophenyl)-3H-benzimidazol-5-amine;hydrochloride
• CAS: 817172-30-8
• 化学式: C₁₃H₁₀ClN₃*ClH
• 分子量: 280.156
• InChiKey: KJYCTZKBCWSEKV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.89
• 重原子数：
  18
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  54.7
• 氢给体数：
  3
• 氢受体数：
  2

文献信息

• Novel anti-inflammatory and analgesic heterocyclic amidines that inhibit nitrogen oxide (NO) production
  申请人：Makovec Francesco

  公开号：US20050197331A1

  公开（公告）日：2005-09-08

  Heterocyclic amidines with anti-inflammatory and analgesic activity that inhibit nitrogen oxide production, of formula (I): in which: G 1 and G 2 are hydrogen, halogen, hydroxyl, C 1 -C 4 alkoxy, C 1 -C 4 alkyl, and an amidino substituent of formula Q, provided that, for each compound of formula (I), only one of the two substituents G 1 or G 2 is an amidino substituent of formula Q: and in which the substituents W, Y and X are combined to form 9- or 10-membered bicyclic heteroaromatic derivatives containing up to 2 hetero atoms in the same ring; and Z is an aryl or heteroaryl group, a linear or branched C 1 -C 6 alkyl or alkenyl chain, a C 1 -C 4 alkyl-aryl group or a C 1 -C 4 alkyl-heteroaryl group.

  含有抗炎和镇痛活性、抑制氮氧化物产生的杂环胺基化合物，化学式（I）如下：其中：G1和G2为氢、卤素、羟基、C1-C4烷氧基、C1-C4烷基和式为Q的胺基取代基，但对于化合物的每个化学式（I），G1或G2中仅有一个是式为Q的胺基取代基；其中取代基W、Y和X结合形成含有最多2个杂原子的同一环中的9-或10-成员双环杂芳衍生物；Z为芳基或杂芳基团、线性或支链状的C1-C6烷基或烯基链、C1-C4烷基-芳基团或C1-C4烷基-杂芳基团。
• Novel Anti-Inflammatory and Analgesic Heterocyclic Amidines that Inhibit Nitrogen Oxide (NO) Production
  申请人：MAKOVEC Francesco

  公开号：US20100120802A1

  公开（公告）日：2010-05-13

  Heterocyclic amidines with anti-inflammatory and analgesic activity that inhibit nitrogen oxide production, of formula (I): in which: G 1 and G 2 are hydrogen, halogen, hydroxyl, C 1 -C 4 alkoxy, C 1 -C 4 alkyl, and an amidino substituent of formula Q, provided that, for each compound of formula (I), only one of the two substituents G 1 or G 2 is an amidino substituent of formula Q: and in which the substituents W, Y and X are combined to form 9- or 10-membered bicyclic heteroaromatic derivatives containing up to 2 hetero atoms in the same ring; and Z is an aryl or heteroaryl group, a linear or branched C 1 -C 6 alkyl or alkenyl chain, a C 1 -C 4 alkyl-aryl group or a C 1 -C 4 alkyl-heteroaryl group.

  具有抗炎和镇痛活性，能够抑制氮氧化物产生的杂环胺基化合物，化学式为（I）：其中：G1和G2是氢，卤素，羟基，C1-C4烷氧基，C1-C4烷基和公式Q的氨基甲基取代基，只有公式（I）中的两个取代基G1或G2中的一个是公式Q的氨基甲基取代基；其中取代基W，Y和X组合形成含有最多2个杂原子的9-或10成员双环杂芳基衍生物；Z是芳基或杂芳基基团，线性或分支的C1-C6烷基或烯基链，C1-C4烷基芳基基团或C1-C4烷基杂芳基基团。
• US7674809B2
  申请人：——

  公开号：US7674809B2

  公开（公告）日：2010-03-09