LG100641 | 116372-01-1

• 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: LG100641
• 英文别名: 2-[(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthyl) carbonyl]benzoic acid；2-[(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthyl)-carbonyl]benzoic acid；2-[(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-2-naphthyl)carbonyl]benzoic acid；2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbonyl)benzoic acid
• CAS: 116372-01-1
• 化学式: C₂₂H₂₄O₃
• 分子量: 336.431
• InChiKey: RIMAGTAWNVQRCT-UHFFFAOYSA-N

物化性质

• 熔点：
  187 °C
• 沸点：
  516.5±50.0 °C(Predicted)
• 密度：
  1.107±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.9
• 重原子数：
  25
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  54.4
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  LG100641 以 水 、 甲苯 为溶剂， 生成 sodium 2-[(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthyl)carbonyl]benzoate
  参考文献：
  名称：

  Bicyclic aromatic compounds, a process for their preparation and their

  摘要：

  具有以下结构式的双环芳香化合物：其中R.sub.1、R.sub.2、R.sub.3和R.sub.4代表氢或烷基，至少两个R.sub.1 -R.sub.4基团不是氢，A代表亚甲基或二亚甲基；当A代表二亚甲基时，R.sub.1和R.sub.3可以共同形成一个亚甲基或二亚甲基基团，R.sub.5和R.sub.6代表氢、卤素、低烷基、低烷氧基或羟基，R'代表氢、羟基、烷氧基、C.sub.1 -C.sub.4环氧基或氨基，R"代表氢或低烷氧基，或者R'和R"共同形成一个氧代、甲基或羟基亚胺基团，B代表环己基、环己烯基、环己二烯基或苯基，取代或不取代，R代表--CH.sub.2 OH或--COR.sub.7，R.sub.7代表氢、--OR.sub.8或R.sub.8代表氢、C.sub.1 -C.sub.20烷基、单羟基烷基、多羟基烷基、芳基、芳基烷基或糖残基。r'和r"代表氢、烷基、单羟基烷基、多羟基烷基、芳基或苄基，氨基酸残基或氨基化糖残基，或共同形成杂环，以及公式I化合物及其光学异构体的盐，以及除了2-[(5,8-甲基-5,6,7,8-四氢-2-萘基)羰基]苯甲酸之外的化合物的互变异构体。这些化合物在治疗具有油性外观的头发和皮肤方面具有用途。

  公开号：

  US04898864A1
• 作为产物：
  描述：

  1,1,4,4-四甲基-1,2,3,4-四氢萘 、 苯酐 生成 LG100641
  参考文献：
  名称：

  MAIGNAN, JEAN;LANG, GERARD;MALLE, GERARD;VINGLER, PHILIPPE

  摘要：

  DOI：

文献信息

• METHODS FOR ENHANCING HEMATOPOIETIC PROGENITOR CELL ENGRAFTMENT
  申请人：Naveiras Olaia

  公开号：US20120101067A1

  公开（公告）日：2012-04-26

  Described herein are methods for improving engraftment of hematopoietic cells in an individual following hematopoietic progenitor cell transplantation (e.g., via bone marrow or cord blood transplantation). Methods for increasing hematopoietic progenitor cell proliferation in individuals with bone marrow aplasia are also described. The methods involve administering an agent that inhibits adipogenesis, adipocyte growth, adipocyte differentiation and/or adipocyte proliferation.
• US4898864A
  申请人：——

  公开号：US4898864A

  公开（公告）日：1990-02-06
• US8546382B2
  申请人：——

  公开号：US8546382B2

  公开（公告）日：2013-10-01
• [EN] METHODS FOR ENHANCING HEMATOPOIETIC PROGENITOR CELL ENGRAFTMENT<br/>[FR] PROCÉDÉS PERMETTANT D'AMÉLIORER LA PRISE DE GREFFE DE CELLULES SOUCHES HÉMATOPOÏÉTIQUES
  申请人：CHILDRENS MEDICAL CENTER

  公开号：WO2010121008A2

  公开（公告）日：2010-10-21

  Described herein are methods for improving engraftment of hematopoietic cells in an individual following hematopoietic progenitor cell transplantation (e.g., via bone marrow or cord blood transplantation). Methods for increasing hematopoietic progenitor cell proliferation in individuals with bone marrow aplasia are also described. The methods involve administering an agent that inhibits adipogenesis, adipocyte growth, adipocyte differentiation and/or adipocyte proliferation.
• Bicyclic aromatic compounds, a process for their preparation and their
  申请人：L'Oreal

  公开号：US04898864A1

  公开（公告）日：1990-02-06

  Bicyclic aromatic compound having the formula ##STR1## wherein R.sub.1, R.sub.2, R.sub.3 and R.sub.4 represent hydrogen or alkyl, at least two of R.sub.1 -R.sub.4 radicals being other than hydrogen, A represents methylene or dimethylene; when A represents dimethylene, R.sub.1 and R.sub.3 together can form a methylene or dimethylene radical, R.sub.5 and R.sub.6 represent hydrogen, halogen, lower alkyl, lower alkoxy or hydroxy, R' represents hydrogen, hydroxy, alkoxy, C.sub.1 -C.sub.4 cicyloxy or amino, R" represents hydrogen or lower alkoxy, or R' and R" together form an oxo, methano or hydroxyimino radical, B represents cyclohexyl, cyclohexenyl, cyclohexadienyl or phenyl, substituted or not, R represents --CH.sub.2 OH or --COR.sub.7, R.sub.7 represents hydrogen, --OR.sub.8 or ##STR2## R.sub.8 represents hydrogen, C.sub.1 -C.sub.20 alkyl, monohydroxyalkyl, polyhydroxyalkyl, aryl, aralkyl or a sugar residue. r' and r" represent hydrogen, alkyl, monohydroxyalkyl, polyhydroxyalkyl, aryl or benzyl, the residue of an amino acid or an aminated sugar, or taken together form a heterocycle, and the salts of the compound of formula I and their optical isomers as well as the tautomeric forms of the compounds of formula I with the exception of 2-[(5,8-methano-5,6,7,8-tetrahydro-2-naphthyl) carbonyl] benzoic acid. The compounds are useful in the treatment of the hair and skin having an oily appearance.

  具有以下结构式的双环芳香化合物：其中R.sub.1、R.sub.2、R.sub.3和R.sub.4代表氢或烷基，至少两个R.sub.1 -R.sub.4基团不是氢，A代表亚甲基或二亚甲基；当A代表二亚甲基时，R.sub.1和R.sub.3可以共同形成一个亚甲基或二亚甲基基团，R.sub.5和R.sub.6代表氢、卤素、低烷基、低烷氧基或羟基，R'代表氢、羟基、烷氧基、C.sub.1 -C.sub.4环氧基或氨基，R"代表氢或低烷氧基，或者R'和R"共同形成一个氧代、甲基或羟基亚胺基团，B代表环己基、环己烯基、环己二烯基或苯基，取代或不取代，R代表--CH.sub.2 OH或--COR.sub.7，R.sub.7代表氢、--OR.sub.8或R.sub.8代表氢、C.sub.1 -C.sub.20烷基、单羟基烷基、多羟基烷基、芳基、芳基烷基或糖残基。r'和r"代表氢、烷基、单羟基烷基、多羟基烷基、芳基或苄基，氨基酸残基或氨基化糖残基，或共同形成杂环，以及公式I化合物及其光学异构体的盐，以及除了2-[(5,8-甲基-5,6,7,8-四氢-2-萘基)羰基]苯甲酸之外的化合物的互变异构体。这些化合物在治疗具有油性外观的头发和皮肤方面具有用途。