4-(4-morpholyl)-2-phenylthiophene | 2832-97-5

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 4-(4-morpholyl)-2-phenylthiophene
• 英文别名: 2-phenyl-4-morpholino-thiophene；2-Phenyl-4-morpholino-thiophen；2-Phenyl-4-N-morpholino-thiophene；4-(5-phenyl-thiophen-3-yl)-morpholine；4-(5-Phenyl-[3]thienyl)-morpholin；4-(5-Phenylthiophen-3-yl)morpholine
• CAS: 2832-97-5
• 化学式: C₁₄H₁₅NOS
• 分子量: 245.345
• InChiKey: SFBJRLYAUGETSK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  40.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-(4-morpholyl)-2-phenylthiophene 、 丁炔二酸二甲酯 以 甲醇 为溶剂， 生成 dimethyl (E)-2-<3-(4-morpholinyl)-5-phenyl-2-thienyl>-2-butenedioate
  参考文献：
  名称：

  Solvent effects in thermal (2 + 2) cycloaddition reactions. Intramolecular capture of 1,4-dipolar intermediates vs. (2 + 2) cycloaddition in reactions of 3-(1-pyrrolidinyl)thiophenes with electron-deficient acetylenes

  摘要：

  DOI：

  10.1021/jo00315a038
• 作为产物：
  描述：

  吗啉 、 4,5-dihydro-5-phenyl-3(2H)-thiophenone 生成 4-(4-morpholyl)-2-phenylthiophene
  参考文献：
  名称：

  Solvent effects in thermal (2 + 2) cycloaddition reactions. Intramolecular capture of 1,4-dipolar intermediates vs. (2 + 2) cycloaddition in reactions of 3-(1-pyrrolidinyl)thiophenes with electron-deficient acetylenes

  摘要：

  DOI：

  10.1021/jo00315a038

文献信息

• [EN] HUMAN ANDROGEN RECEPTOR DNA-BINDING DOMAIN (DBD) COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE<br/>[FR] COMPOSÉS CIBLANT LE DOMAINE DE LIAISON À L'ADN (DBD) DU RÉCEPTEUR DES ANDROGÈNES HUMAIN SERVANT D'AGENTS THÉRAPEUTIQUES ET PROCÉDÉS POUR LEUR UTILISATION
  申请人：UNIV BRITISH COLUMBIA

  公开号：WO2015120543A1

  公开（公告）日：2015-08-20

  A compound having the structure of Formula I, wherein A is a substituted or unsubstituted aryl or heteroaryl group, D is a substituted or unsubstituted 5- or 6-mcmbcrcd heteroaryl or heterocyclyl group and E is a substituted or unsubstituted aryl, heteroaryl, cycloalkyl or heterocyclyl group. The compounds are used for the treatment of androgen modulated indications including cancer (prostate, breast, ovarian, endometrial or blader cancer), hair loss, acne, hirsutism, ovarian cysts, polycystic ovary disease, precocious puberty and age related macular degeneration. The use of the compounds for the manufacture of a medicament for modulating AR activity, a method of treatment using such compounds and a pharmaceutical composition and a commercial package comprising said compounds arc also described.

  一种具有公式I结构的化合物，其中A是取代或未取代的芳基或杂芳基基团，D是取代或未取代的5-或6-成员杂芳基或杂环基基团，E是取代或未取代的芳基，杂芳基，环烷基或杂环基基团。这些化合物用于治疗雄激素调节的症状，包括癌症（前列腺，乳腺，卵巢，子宫内膜或膀胱癌），脱发，痤疮，多毛症，卵巢囊肿，多囊卵巢综合症，早熟和年龄相关性黄斑变性。还描述了使用这些化合物制造调节雄激素受体活性的药物、使用这些化合物的治疗方法、以及包含这些化合物的制药组合物和商业包装。
• Human androgen receptor DNA-binding domain (DBD) compounds as therapeutics and methods for their use
  申请人：The University of British Columbia

  公开号：US10011573B2

  公开（公告）日：2018-07-03

  A compound having the structure of Formula I, wherein A is a substituted or unsubstituted aryl or heteroaryl group, D is a substituted or unsubstituted 5- or 6-membered heteroaryl or heterocyclyl group and E is a substituted or unsubstituted aryl, heteroaryl, cycloalkyl or heterocyclyl group. The compounds are used for the treatment of androgen modulated indications including cancer (prostate, breast, ovarian, endometrial or bladder cancer), hair loss, acne, hirsutism, ovarian cysts, polycystic ovary disease, precocious puberty and age related macular degeneration. The use of the compounds for the manufacture of a medicament for modulating AR activity, a method of treatment using such compounds and a pharmaceutical composition and a commercial package comprising said compounds are also described.

  具有式 I 结构的化合物，其中 A 是取代或未取代的芳基或杂芳基，D 是取代或未取代的 5 或 6 元杂芳基或杂环基，E 是取代或未取代的芳基、杂芳基、环烷基或杂环基。这些化合物可用于治疗雄激素调节适应症，包括癌症（前列腺癌、乳腺癌、卵巢癌、子宫内膜癌或膀胱癌）、脱发、痤疮、多毛症、卵巢囊肿、多囊卵巢病、性早熟和老年性黄斑变性。此外，还描述了这些化合物在制造调节 AR 活性的药物中的用途、使用这些化合物的治疗方法以及包含上述化合物的药物组合物和商业包装。
• Hartmann,H.; Scheithauer,S., Journal fur praktische Chemie (Leipzig 1954), 1969, vol. 311, p. 827 - 843
  作者：Hartmann,H.、Scheithauer,S.

  DOI：——

  日期：——
• Studies on the Willgerodt-Kindler reaction. Morpholino-thiophenes from acetylene-ketones, from β-diketones and from analogous compounds.
  作者：T. Bacchetti、A. Alemagna、B. Danieli

  DOI：10.1016/s0040-4039(01)83900-9

  日期：1965.1
• The Willgerodt Reaction with Acetylphenyl-acetylene and Benzalacetone
  作者：Dorothy. Nightingale、Richard A. Carpenter

  DOI：10.1021/ja01178a525

  日期：1949.10