(E)-3-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)acrylic acid | 1165739-40-1

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 肉桂酸及其衍生物
• 英文名称: (E)-3-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)acrylic acid
• 英文别名: 3-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)acrylic acid；(E)-(5,6,7,8-tetrahydro-5,5,8,8-tetramethylnaphthalen-2-yl)acrylic acid；(E)-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-2-enoic acid
• CAS: 1165739-40-1
• 化学式: C₁₇H₂₂O₂
• mdl: MFCD27824477
• 分子量: 258.36
• InChiKey: LMVVJMGWZNMWQX-SOFGYWHQSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  37.3
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (E)-3-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)acrylic acid 在 氯化亚砜 作用下， 以 苯 为溶剂， 反应 2.0h， 生成 3-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)acryloyl chloride
  参考文献：
  名称：

  EP1357104

  摘要：

  公开号：
• 作为产物：
  描述：

  丙二酸 、 5,5,8,8-四甲基-5,6,7,8-四氢-2-萘甲醛 在 哌啶 、 吡啶 作用下， 反应 2.0h， 以94%的产率得到(E)-3-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)acrylic acid
  参考文献：
  名称：

  Design, synthesis, and biological evaluation of novel diarylalkyl amides as TRPV1 antagonists

  摘要：

  We have developed a new class of diarylalkyl amides as novel TRPV1 antagonists. They exhibited potent Ca-45(2+) uptake inhibitions in rat DRG neuron. In particular, the amide 59 was identified as a potent antagonist with IC50 of 57 nM. The synthesis and structure-activity relationship of the diarylalkyl amides are also described. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2009.04.010

文献信息

• Bi-aromatic compounds, compositions containing them and uses
  申请人：Centre International de Recherches Dermatologiques

  公开号：US06326510B1

  公开（公告）日：2001-12-04

  The invention relates to novel biaromatic compounds having general formula I and their use in pharmaceutical compositions for use in human and veterinary medicine, in particular for treating dermatological, rheumatic, respiratory, cardiovascular, and ophthalmological disorders, and for use in cosmetic compositions.

  该发明涉及具有一般式I的新型双芳香化合物及其在人类和兽医药物组合物中的应用，特别用于治疗皮肤病、风湿病、呼吸系统疾病、心血管疾病和眼科疾病，并用于化妆品组合物中。
• TROPOLONE DERIVATIVE
  申请人：Research Foundation Itsuu Laboratory

  公开号：EP1357104A1

  公开（公告）日：2003-10-29

  Tropolone derivatives represented by the formula (I), which have retinoid actions and are useful as active ingredients of medicaments [R1 to R4 represent hydrogen atom, an alkyl group, or an alkoxyl group; the ring represented by Ar represents an aryl ring or a heteroaryl ring; X represents a single bond, -N=N-,-CON(R5)-, -(C=C)nCON(R6)-, -N(R7)CON(R8)-, -SO2N(R9)-, -N(R10)- (R5 to R9 represent hydrogen atom or an alkyl group, n represents 1 to 3, R10 represents hydrogen atom, an alkyl group, or an acyl group), an alkylene group, an aryldiyl group, or a heterocyclic diyl group; Y represents hydrogen atom, -OR11 (R11 represents hydrogen atom, an alkyl group, or an acyl group), -NHR12 (R12 represents hydrogen atom, an alkyl group, an acyl group, or amino group), or a halogen atom.

  式(I)所代表的具有维甲酸作用并可用作药物活性成分的托勃龙衍生物 [R1 至 R4 代表氢原子、烷基或烷氧基；Ar 所代表的环代表芳基环或杂芳基环；X 代表单键、-N=N-、-CON(R5)-、-(C=C)nCON(R6)-、-N(R7)CON(R8)-、-SO2N(R9)-、-N(R10)-（R5 至 R9 代表氢原子或烷基，n 代表 1 至 3，R10 代表氢原子、烷基或酰基）、亚烷基、芳二基或杂环二基；Y 代表氢原子、-OR11（R11 代表氢原子、烷基或酰基）、-NHR12（R12 代表氢原子、烷基、酰基或氨基）或卤素原子。
• COMPOSES BIAROMATIQUES, COMPOSITIONS LES CONTENANT ET UTILISATIONS
  申请人：CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA)

  公开号：EP0901462A1

  公开（公告）日：1999-03-17
• Tropolone derivative
  申请人：——

  公开号：US20040082550A1

  公开（公告）日：2004-04-29

  Tropolone derivatives represented by the formula (I), which have retinoid actions and are useful as active ingredients of medicaments [R 1 to R 4 represent hydrogen atom, an alkyl group, or an alkoxyl group; the ring represented by Ar represents an aryl ring or a heteroaryl ring; X represents a single bond, —N═N—, —CON(R 5 )—, —(C═C) n CON(R 6 )—, —N(R 7 )CON(R 8 )—, —SO 2 N(R 9 )—, —N(R 10 )— (R 5 to R 9 represent hydrogen atom or an alkyl group, n represents 1 to 3, R 10 represents hydrogen atom, an alkyl group, or an acyl group), an alkylene group, an aryldiyl group, or a heterocyclic diyl group; Y represents hydrogen atom, —OR 11 (R 11 represents hydrogen atom, an alkyl group, or an acyl group), —NHR 12 (R 12 represents hydrogen atom, an alkyl group, an acyl group, or amino group), or a halogen atom. 1
• US6326510B1
  申请人：——

  公开号：US6326510B1

  公开（公告）日：2001-12-04