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m-aminobenzyl allyl ether | 117401-78-2

中文名称
——
中文别名
——
英文名称
m-aminobenzyl allyl ether
英文别名
3-allyloxymethylphenylamine;Benzenamine, 3-[(2-propen-1-yloxy)methyl]-;3-(prop-2-enoxymethyl)aniline
m-aminobenzyl allyl ether化学式
CAS
117401-78-2
化学式
C10H13NO
mdl
——
分子量
163.219
InChiKey
UZQPHVZZJGPGNW-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    1.1
  • 重原子数:
    12
  • 可旋转键数:
    4
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.2
  • 拓扑面积:
    35.2
  • 氢给体数:
    1
  • 氢受体数:
    2

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    m-aminobenzyl allyl ether盐酸 、 lithium hydroxide 、 sodium periodate四氧化锇正丁基锂 、 sodium azide 、 N,N'-二环己基碳二亚胺 、 sodium nitrite 作用下, 以 甲醇乙二醇二甲醚二氯甲烷N,N-二甲基甲酰胺 为溶剂, 反应 198.92h, 生成 N-<(6-m-azidobenzyloxy)-E,E-2,4-hexadienoamide>-L-tyrosyl-N,N'-di-Boc-spermine-N-α-NG,NG'-tri-Boc-L-arginine di-amide
    参考文献:
    名称:
    Synthesis of novel and photolabile philanthotoxin analogs: Glutamate receptor antagonists
    摘要:
    The synthetic methods for 27 novel and photolabile philanthotoxin analogs are described. Most analogs were synthesized by two general methods with modifications of these methods where necessary.
    DOI:
    10.1016/s0040-4020(01)81575-1
  • 作为产物:
    描述:
    3-硝基苯甲醇potassium tert-butylate 、 tin(ll) chloride 作用下, 以 乙醇 为溶剂, 反应 11.0h, 生成 m-aminobenzyl allyl ether
    参考文献:
    名称:
    Synthesis of novel and photolabile philanthotoxin analogs: Glutamate receptor antagonists
    摘要:
    The synthetic methods for 27 novel and photolabile philanthotoxin analogs are described. Most analogs were synthesized by two general methods with modifications of these methods where necessary.
    DOI:
    10.1016/s0040-4020(01)81575-1
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文献信息

  • OXYGEN LINKED PYRIMIDINE DERIVATIVES
    申请人:Blanchard Stephanie
    公开号:US20120196855A1
    公开(公告)日:2012-08-02
    The present invention relates to pyrimidine compounds that are useful as anti-proliferative agents. More particularly, the present invention relates to oxygen linked and substituted pyrimidine compounds, methods for their preparation, pharmaceutical compositions containing these compounds and uses of these compounds in the treatment of proliferative disorders. These compounds may be useful as medicaments for the treatment of a number of proliferative disorders including tumours and cancers as well as other disorders or conditions related to or associated with kinases.
    本发明涉及嘧啶化合物,其作为抗增殖剂具有用处。更具体地说,本发明涉及氧连接和取代的嘧啶化合物,其制备方法,含有这些化合物的制药组合物以及这些化合物在治疗增殖性疾病方面的用途。这些化合物可用作治疗许多增殖性疾病,包括肿瘤和癌症以及与激酶相关或相关的其他疾病或病况的药物。
  • HETEROALKYL LINKED PYRIMIDINE DERIVATIVES
    申请人:Blanchard Stephanie
    公开号:US20090258886A1
    公开(公告)日:2009-10-15
    The present invention relates to pyrimidine compounds that are useful as anti-proliferative agents. More particularly, the present invention relates to heteroalkyl linked and substituted pyrimidine compounds, methods for their preparation, pharmaceutical compositions containing these compounds and uses of these compounds in the treatment of proliferative disorders. These compounds may be useful as medicaments for the treatment of a number of proliferative disorders including tumours and cancers as well as other conditions or disorders associated with kinases.
    本发明涉及用作抗增殖剂的嘧啶化合物。更具体地说,本发明涉及杂原子烷基连接和取代的嘧啶化合物,其制备方法,含有这些化合物的制药组合物以及在治疗增殖性疾病中使用这些化合物的用途。这些化合物可能作为药物对许多增殖性疾病,包括肿瘤和癌症以及与激酶相关的其他疾病或疾病的治疗有用。
  • Oxygen linked pyrimidine derivatives
    申请人:CTI BIOPHARMA CORP.
    公开号:US11135227B2
    公开(公告)日:2021-10-05
    The present invention relates to pyrimidine compounds that are useful as anti-proliferative agents. More particularly, the present invention relates to oxygen linked and substituted pyrimidine compounds, methods for their preparation, pharmaceutical compositions containing these compounds and uses of these compounds in the treatment of proliferative disorders. These compounds may be useful as medicaments for the treatment of a number of proliferative disorders including tumours and cancers as well as other disorders or conditions related to or associated with kinases.
    本发明涉及可用作抗增殖剂的嘧啶化合物。 更具体地说,本发明涉及氧连接和取代的嘧啶化合物、其制备方法、含有这些化合物的药物组合物以及这些化合物在治疗增殖性疾病中的用途。 这些化合物可用作治疗多种增殖性疾病的药物,包括肿瘤和癌症以及与激酶有关或相关的其他疾病或病症。
  • Discovery of the Macrocycle (9<i>E</i>)-15-(2-(Pyrrolidin-1-yl)ethoxy)-7,12,25-trioxa-19,21,24-triaza-tetracyclo[18.3.1.1(2,5).1(14,18)]hexacosa-1(24),2,4,9,14(26),15,17,20,22-nonaene (SB1578), a Potent Inhibitor of Janus Kinase 2/Fms-LikeTyrosine Kinase-3 (JAK2/FLT3) for the Treatment of Rheumatoid Arthritis
    作者:Anthony D. William、Angeline C.-H. Lee、Anders Poulsen、Kee Chuan Goh、Babita Madan、Stefan Hart、Evelyn Tan、Haishan Wang、Harish Nagaraj、Dizhong Chen、Chai Ping Lee、Eric T. Sun、Ramesh Jayaraman、Mohammad Khalid Pasha、Kantharaj Ethirajulu、Jeanette M. Wood、Brian W. Dymock
    DOI:10.1021/jm201454n
    日期:2012.3.22
    Herein, we describe the synthesis and SAR of a series of small molecule macrocycles that selectively inhibit JAK2 kinase within the JAK family and FLT3 kinase. Following a multiparameter optimization of a key aryl ring of the previously described SB1518 (pacritinib), the highly soluble 141 was selected as the optimal compound. Oral efficacy in the murine collagen-induced arthritis (CIA) model for rheumatoid arthritis (RA) supported 141 as a potential treatment for autoimmune diseases and inflammatory disorders such as psoriasis and RA. Compound 141 (SB1578) was progressed into development and is currently undergoing phase 1 clinical trials in healthy volunteers.
  • WO2007/58627
    申请人:——
    公开号:——
    公开(公告)日:——
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