5-methyl-2-(4-(4-bromomethylphenyl)-thien-3-yl)-[1,3,4]oxadiazole | 178201-85-9

• 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: 5-methyl-2-(4-(4-bromomethylphenyl)-thien-3-yl)-[1,3,4]oxadiazole
• 英文别名: 5-methyl-2-(4-(4-bromomethylphenyl)-3-thienyl)-[1,3,4]oxadiazole；2-[4-[4-(bromomethyl)phenyl]thiophen-3-yl]-5-methyl-1,3,4-oxadiazole
• CAS: 178201-85-9
• 化学式: C₁₄H₁₁BrN₂OS
• 分子量: 335.224
• InChiKey: XGVTYZVWVYHTFY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  67.2
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3-t-butoxy-carbonylamino-3-methyl-N-[2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-3(R)-yl]-butanamide 、 5-methyl-2-(4-(4-bromomethylphenyl)-thien-3-yl)-[1,3,4]oxadiazole 在 盐酸 、 sodium hydride 作用下， 生成 3-Amino-3-methyl-N-((R)-1-{4-[4-(5-methyl-[1,3,4]oxadiazol-2-yl)-thiophen-3-yl]-benzyl}-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-yl)-butyramide
  参考文献：
  名称：

  INVESTIGATION OF BIOISOSTERS OF THE GROWTH HORMONE SECRETAGOGUE L-692,429.

  摘要：

  The synthesis and structure-activity relationships of several analogs of L-692,429 with modifications in the biaryl and tetrazole moieties are described and several derivatives were found to be equipotent or slightly more potent than L-692,429. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)00216-3
• 作为产物：
  描述：

  5-(4-(4-methylphenyl)-thien-3-yl)-tetrazole 在 N-溴代丁二酰亚胺(NBS) 、 偶氮二异丁腈 作用下， 以 四氯化碳 为溶剂， 生成 5-methyl-2-(4-(4-bromomethylphenyl)-thien-3-yl)-[1,3,4]oxadiazole
  参考文献：
  名称：

  INVESTIGATION OF BIOISOSTERS OF THE GROWTH HORMONE SECRETAGOGUE L-692,429.

  摘要：

  The synthesis and structure-activity relationships of several analogs of L-692,429 with modifications in the biaryl and tetrazole moieties are described and several derivatives were found to be equipotent or slightly more potent than L-692,429. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)00216-3

文献信息

• N-substituted naphthofused lactams
  申请人：Novo Nordisk A/S

  公开号：US05817654A1

  公开（公告）日：1998-10-06

  The present invention relates to novel N-substituted naphthofused lactams and salts thereof of the formula ##STR1## Compounds of the general formula I possess the ability to stimulate the release of endogenous growth hormone. Thus, these compounds may be used in the treatment of conditions which require stimulation of growth hormone production or secretion such as in humans with growth hormone deficiency or where increased growth hormone plasma levels are desired, for instance in elderly patients or in livestock.

  本发明涉及新型N-取代萘并内酰胺及其盐的化合物，其化学式为##STR1## 具有通式I的化合物具有刺激内源性生长激素释放的能力。因此，这些化合物可用于治疗需要刺激生长激素产生或分泌的情况，例如具有生长激素缺乏症的人类，或者需要增加生长激素血浆水平的情况，例如老年患者或家畜。
• NOVEL N-SUBSTITUTED NAPHTHOFUSED LACTAMS
  申请人：NOVO NORDISK A/S

  公开号：EP0777668A1

  公开（公告）日：1997-06-11
• US5817654A
  申请人：——

  公开号：US5817654A

  公开（公告）日：1998-10-06
• [EN] NOVEL N-SUBSTITUTED NAPHTHOFUSED LACTAMS<br/>[FR] NOUVEAUX LACTAMES NAPHTOFUSIONNES A SUBSTITUTION N
  申请人：NOVO NORDISK A/S

  公开号：WO1996005195A1

  公开（公告）日：1996-02-22

  (EN) Disclosed are novel N-substituted naphthofused lactams and salts thereof of formula (I). Compounds of general formula (I) possess the ability to stimulate the release of endogenous growth hormone. Thus, these compounds may be used in the treatment of conditions which require stimulation of growth hormone production or secretion such as in humans with growth hormone deficiency or where increased growth hormone plasma levels are desired, for instance in elderly patients or in livestock.(FR) L'invention concerne de nouveaux lactames naphtofusionnés à substitution N ainsi que leurs sels de formule (I). Les composés de formule (I) présentent la capacité de stimuler la libération de l'hormone de croissance endogène. Ainsi, on peut utiliser ces composés dans le traitement d'états nécessitant une stimulation de la production ou de la sécrétion de l'hormone de croissance tels que chez des individus présentant une carence en hormone de croissance ou lorsque l'on veut augmenter les niveaux d'hormone de croissance dans le plasma, par exemple chez des patients agés ou chez des animaux d'élevage.
• INVESTIGATION OF BIOISOSTERS OF THE GROWTH HORMONE SECRETAGOGUE L-692,429.
  作者：Michael Ankersen、Bernd Peschke、Birgit Sehested Hansen、Thomas Kruse Hansen

  DOI：10.1016/s0960-894x(97)00216-3

  日期：1997.5

  The synthesis and structure-activity relationships of several analogs of L-692,429 with modifications in the biaryl and tetrazole moieties are described and several derivatives were found to be equipotent or slightly more potent than L-692,429. (C) 1997 Elsevier Science Ltd.