1-morpholinopropane-2-thiol | 1005-59-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 恶嗪烷类
• 英文名称: 1-morpholinopropane-2-thiol
• 英文别名: 1-morpholin-4-yl-propane-2-thiol；1-Morpholino-2-mercapto-propan；1-Morpholino-propan-2-thiol；Morpholino-propan-2-thiol；1-morpholin-4-ylpropane-2-thiol
• CAS: 1005-59-0
• 化学式: C₇H₁₅NOS
• 分子量: 161.268
• InChiKey: LRXYLEJATHAPGZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.6
• 重原子数：
  10
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  13.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-morpholinopropane-2-thiol 生成 2,7-bis-[3-(1-methyl-2-morpholin-4-yl-ethylsulfanyl)-propyl]-benzo[lmn][3,8]phenanthroline-1,3,6,8-tetraone
  参考文献：
  名称：

  Schuetz; Kurz; Pluempe, Arzneimittel-Forschung/Drug Research, 1971, vol. 21, # 6, p. 739 - 763

  摘要：

  DOI：

文献信息

• KRAS G12C INHIBITORS AND METHODS OF USING THE SAME
  申请人：AMGEN INC.

  公开号：US20180177767A1

  公开（公告）日：2018-06-28

  Provided herein are KRAS G12C inhibitors, composition of the same, and methods of using the same. These inhibitors are useful for treating a number of disorders, including pancreatic, colorectal, and lung cancers.

  本文提供了KRAS G12C抑制剂，其组成，以及使用方法。这些抑制剂对治疗多种疾病有用，包括胰腺癌、结直肠癌和肺癌。
• Reactions of aliphatic, aromatic, and heterocyclic aminothiols with diacetylene
  作者：A. N. Volkov、K. A. Volkova

  DOI：10.1007/s11178-005-0078-1

  日期：2004.11

  Reactions of aliphatic, aromatic, and heterocyclic aminothiols with diacetylene in liquid ammonia or methanol furnished the corresponding aminoorganylsulfanylbutenynes of predominantly Z-configuration.

  脂肪族、芳香族和杂环氨基硫醇与二乙炔在液氨或甲醇中反应，生成主要为Z-构型的相应氨基有机硫烷丁炔。
• Compounds and uses thereof
  申请人：Kala Pharmaceuticals, Inc.

  公开号：US10544151B2

  公开（公告）日：2020-01-28

  The present invention provides novel compounds of any one of Formulae (I)-(IV), and pharmaceutical compositions thereof. Also provided are particles (e.g., nanoparticles) comprising compounds of any one of Formulae (I)-(IV) and pharmaceutical compositions thereof that are mucus penetrating. The invention also provides methods and kits for using the inventive compounds, and pharmaceutical compositions thereof, for treating and/or preventing diseases associated with abnormal or pathological angiogenesis and/or aberrant signaling of a growth factor signaling pathway (e.g., vascular endothelial growth factor (VEGF), such as proliferative diseases (e.g., cancers, benign neoplasms, inflammatory diseases, autoimmune diseases) and ocular diseases (e.g., macular degeneration, glaucoma, diabetic retinopathy, retinoblastoma, edema, uveitis, dry eye, blepharitis, and post-surgical inflammation) in a subject in need thereof.

  本发明提供了式(I)-(IV)中任一项的新型化合物及其药物组合物。本发明还提供了由式（I）-（IV）中任意一种化合物及其药物组合物组成的具有粘液渗透性的颗粒（如纳米颗粒）。本发明还提供了使用本发明化合物及其药物组合物治疗和/或预防与异常或病理性血管生成和/或生长因子信号通路异常信号转导（如......血管内皮生长因子）相关疾病的方法和试剂盒、血管内皮生长因子（VEGF））相关的疾病，如增殖性疾病（如癌症、良性肿瘤、炎症性疾病、自身免疫性疾病）和眼部疾病（如黄斑变性、青光眼、糖尿病视网膜病变、视网膜母细胞瘤、水肿、葡萄膜炎、干眼症、睑缘炎和手术后炎症）。
• Peptide and peptide mimetic binding antagonists of polo-like kinase 1 polo box domain and methods of use
  申请人：The United States of America, as represented by the Secretary, Department of Health & Human Services

  公开号：US10905769B2

  公开（公告）日：2021-02-02

  The description provides novel compounds that may serve as anticancer therapeutics. The compounds of the description bind to polo-like kinases through the polo-box domain. The peptide derivatives of the description have achieved improved efficacy in biochemical assays against Plk1. Exemplary compounds of the description include macrocyclic peptidomimetics with high affinity and selectivity for polo-like kinases, which may provide the basis for a new genre of anticancer therapeutics. Other exemplary compounds of the description include bi-valent compounds with that bind to polo-like kinases through both kinase domain and polo-box domain simultaneously by incorporating additional moieties that target Plk1 kinase domain, which significantly enhances affinitity relative and may provide the basis for a new genre of anticancer therapeutics. The description also provides methods of use, methods of preparation, compositions, and kits thereof. Further, the description provides a novel method of design and/or synthesis of phosphoryl-derived peptide derivatives useful as therapeutic agents.

  说明提供了可用作抗癌疗法的新型化合物。所述化合物通过 polo-box 结构域与 polo-like 激酶结合。描述中的肽衍生物在生化试验中对 Plk1 的疗效有所提高。本发明的示例化合物包括对polo-like激酶具有高亲和力和选择性的大环肽拟化物，可为新型抗癌疗法奠定基础。本发明的其他示例化合物包括双价化合物，它们通过加入靶向 Plk1 激酶结构域的附加分子，同时通过激酶结构域和 polo-box 结构域与 polo-like 激酶结合，从而显著增强了亲和性，并可为新型抗癌疗法奠定基础。说明还提供了使用方法、制备方法、组合物及其试剂盒。此外，该描述还提供了一种设计和/或合成可用作治疗剂的磷酸衍生肽衍生物的新方法。
• Urea derivatives and uses thereof
  申请人：Kala Pharmaceuticals, Inc.

  公开号：US11352343B2

  公开（公告）日：2022-06-07

  The present invention provides novel compounds of any one of Formulae (I)-(III), and pharmaceutical compositions thereof. Also provided are particles (e.g., nanoparticles) comprising compounds of Formula (I)-(III) and pharmaceutical compositions thereof that are mucus penetrating. The invention also provides methods and kits for using the inventive compounds, and pharmaceutical compositions thereof, for treating and/or preventing diseases associated with abnormal or pathological angiogenesis and/or aberrant signaling of a growth factor (e.g., vascular endothelial growth factor (VEGF)), such as proliferative diseases (e.g., cancers, benign neoplasms, inflammatory diseases, autoimmune diseases) and ocular diseases (e.g., macular degeneration, glaucoma, diabetic retinopathy, retinoblastoma, edema, uveitis, dry eye, blepharitis, and post-surgical inflammation) in a subject in need thereof.

  本发明提供了式(I)-(III)中任一项的新型化合物及其药物组合物。本发明还提供了由式（I）-（III）化合物及其药物组合物组成的具有粘液渗透性的颗粒（如纳米颗粒）。本发明还提供了使用本发明化合物及其药物组合物治疗和/或预防与异常或病理性血管生成和/或生长因子（如血管内皮生长因子 (VEGF)）异常信号转导相关疾病的方法和试剂盒，如增殖性疾病（如、如癌症、良性肿瘤、炎症性疾病、自身免疫性疾病）和眼部疾病（如黄斑变性、青光眼、糖尿病视网膜病变、视网膜母细胞瘤、水肿、葡萄膜炎、干眼症、睑缘炎和手术后炎症）。