butyl-(2-morpholin-4-yl-ethyl)-amine | 34847-69-3

• 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: butyl-(2-morpholin-4-yl-ethyl)-amine
• 英文别名: butyl-(2-morpholino-ethyl)-amine；Butyl-(2-morpholino-aethyl)-amin；N-butyl-4-Morpholineethanamine；N-(2-morpholin-4-ylethyl)butan-1-amine
• CAS: 34847-69-3
• 化学式: C₁₀H₂₂N₂O
• mdl: MFCD11146020
• 分子量: 186.297
• InChiKey: UBHYRARLLMRZEO-UHFFFAOYSA-N

物化性质

• 沸点：
  267.3±20.0 °C(Predicted)
• 密度：
  0.926±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  13
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  24.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  butyl-(2-morpholin-4-yl-ethyl)-amine 、 <(p-Chlorophenoxy)methyl>thiirane 生成 1-[butyl-(2-morpholin-4-yl-ethyl)-amino]-3-(4-chloro-phenoxy)-propane-2-thiol
  参考文献：
  名称：

  [关于苯基缩水甘油醚衍生物的研究。VI。苯氧丙烯硫化物与胺或格氏试剂的反应]

  摘要：

  DOI：

  10.1248/yakushi1947.92.9_1117
• 作为产物：
  描述：

  在 巯基乙酸 、 三乙胺 作用下， 以 乙酸乙酯 为溶剂， 反应 3.0h， 生成 butyl-(2-morpholin-4-yl-ethyl)-amine
  参考文献：
  名称：

  Synthesis and pharmacological evaluation of 1,1,3-substituted urea derivatives as potent TNF-α production inhibitors

  摘要：

  A three substituted urea derivative, SA13353 (compound 1a), exhibited potent inhibitory activity against lipopolysaccharide (LPS)-induced TNF-alpha production. We focused on the 1,1-substituted moiety (R(1) and R(2)) of SA13353 and investigated substituent effects of this moiety on LPS-induced TNF-alpha production by oral administration in rats. The synthesis of the urea derivatives was performed rapidly in a one-pot manner using a manual synthesizer. Several compounds containing hydrophobic substituents at this moiety showed more potent inhibitory activities than SA13353. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.06.037

文献信息

• Ophthalmic Compositions for Treating Ocular Hypertension
  申请人：Doherty James B.

  公开号：US20090062280A1

  公开（公告）日：2009-03-05

  This invention relates to the use of potent potassium channel blockers or a formulation thereof in the treatment of glaucoma and other conditions which leads to elevated intraocular pressure in the eye of a patient. This invention also relates to the use of such compounds to provide a neuroprotective effect to the eye of mammalian species, particularly humans.

  本发明涉及在治疗青光眼和其他导致患者眼内压升高的疾病中使用强效钾通道阻滞剂或其配方。本发明还涉及使用这些化合物在哺乳动物，特别是人类的眼中提供神经保护作用。
• GYRASE INHIBITORS
  申请人：Creighton Christopher J.

  公开号：US20130079323A1

  公开（公告）日：2013-03-28

  Novel gyrase inhibitors and related compositions and methods are useful for impeding bacterial growth. Compounds of Formula (I), are disclosed: Formula (I), wherein Y is N or CH; Z is N or CR 5 ; R 5 is H, a substituted or unsubstituted hydrocarbyl residue (1-3C) containing 0-2 heteroatoms selected from O, S and N, or is an inorganic residue; L is O, S, NR 7 , or CR 8 R 9 ; R 7 is H or C 1-3 alkyl; R 8 and R 9 are each independently H or C 1-3 alkyl; R 2 is H, a hydrocarbyl residue (1-40C) containing 0-10 heteroatoms selected from O, S and N optionally substituted with an inorganic residue; R 4 is H, an inorganic residue, or a hydrocarbyl residue (1-30C) containing 0-12 heteroatoms selected from O, S and N and containing 0-10 inorganic residues, wherein R 5 and R 4 together may join to form a fused ring; and R 6 is selected from the group consisting of H, C 1-5 alkyl, C 2-5 alkenyl, C 2-5 alkynyl, halo C 1-5 alkyl, halo C 2-5 alkenyl, halo C 2-5 alkynyl, C 1-5 hydroxyalkyl, C 1-5 alkyl chloride, C 2-5 alkenyl chloride, and C 2-5 alkynyl chloride; or a pharmaceutically-acceptable salt, ester, or prodrug thereof.

  新型螺旋酶抑制剂及相关组合物和方法，适用于阻碍细菌生长。其中公开了式（I）的化合物：式（I），其中Y为N或CH；Z为N或CR5；R5为H，含有0-2个来自O、S和N的杂原子的取代或未取代的碳氢基残基（1-3C），或为无机残基；L为O、S、NR7或CR8R9；R7为H或C1-3烷基；R8和R9各自独立地为H或C1-3烷基；R2为H，含有0-10个来自O、S和N的杂原子的碳氢基残基（1-40C），可选地取代为无机残基；R4为H、无机残基或含有0-12个来自O、S和N的杂原子和含有0-10个无机残基的碳氢基残基（1-30C），其中R5和R4可以共同形成融合环；R6选自H、C1-5烷基、C2-5烯基、C2-5炔基、卤代C1-5烷基、卤代C2-5烯基、卤代C2-5炔基、C1-5羟基烷基、C1-5氯代烷基、C2-5氯代烯基和C2-5氯代炔基的群；或其药学上可接受的盐、酯或前药。
• Wadia et al., Journal Of Scientific and Industrial Research, 1958, vol. 17B, p. 11,20
  作者：Wadia et al.

  DOI：——

  日期：——
• Ethers and Amines from β-4-Morpholinoethyl Chloride
  作者：J. Philip Mason、Saul Malkiel

  DOI：10.1021/ja01863a033

  日期：1940.6
• Studies on Phenyl Glycidyl Ether Derivatives. III. : Pharmacological Studies on 1-[4-Chloro (or 2, 4-Dichloro) phenoxy]-3-dialkylamino-2-propanol Derivatives
  作者：TOZABURO KURIHARA、HIDEO TAKEDA、KEIKO SAGAWA、KATSUICHI MATSUO、TOMONORI MATSUMOTO、MASAYOSHI SUZUKI、AKIO SATO、KATUO HARADA

  DOI：10.1248/yakushi1947.89.2_194

  日期：——