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1,4,4-tricarbethoxypiperidine | 40339-69-3

中文名称
——
中文别名
——
英文名称
1,4,4-tricarbethoxypiperidine
英文别名
Piperidin-1,4,4-tricarbonsaeuretriethylester;triethyl piperidine-1,4,4-tricarboxylate
1,4,4-tricarbethoxypiperidine化学式
CAS
40339-69-3
化学式
C14H23NO6
mdl
——
分子量
301.34
InChiKey
PUAFJFGFWLXOMS-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

物化性质

  • 沸点:
    358.4±42.0 °C(Predicted)
  • 密度:
    1.166±0.06 g/cm3(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    1.5
  • 重原子数:
    21
  • 可旋转键数:
    8
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.79
  • 拓扑面积:
    82.1
  • 氢给体数:
    0
  • 氢受体数:
    6

反应信息

  • 作为反应物:
    描述:
    1,4,4-tricarbethoxypiperidine氯甲酸苄酯 以there was obtained benzyl 4,4-dicarbethoxypiperidine-1-carboxylate in the form of an oil的产率得到benzyl 4,4-dicarbethoxypiperidine-1-carboxylate
    参考文献:
    名称:
    Cyclic hydrazine derivatives
    摘要:
    肼衍生物及其药用可接受盐,用于治疗炎症和自身免疫性疾病、骨关节炎、呼吸系统疾病、肿瘤、消瘦症、心血管疾病、发热、出血和败血症。
    公开号:
    US06281363B1
  • 作为产物:
    描述:
    双(2-溴乙基)胺氢溴酸盐sodium hydroxide 、 sodium hydride 作用下, 以 N,N-二甲基甲酰胺 为溶剂, 反应 12.0h, 生成 1,4,4-tricarbethoxypiperidine
    参考文献:
    名称:
    Huybrechts, S.; Hoornaert, G. J., Synthetic Communications, 1981, vol. 11, # 1, p. 17 - 24
    摘要:
    DOI:
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文献信息

  • HUYBRECHTS S.; HOORNAERT G. J., SYNTH. COMMUN., 1981, 11, NO 1, 17-23
    作者:HUYBRECHTS S.、 HOORNAERT G. J.
    DOI:——
    日期:——
  • CYCLIC HYDRAZINE DERIVATIVES AS TNF-ALPHA INHIBITORS
    申请人:F. HOFFMANN-LA ROCHE AG
    公开号:EP1137640A1
    公开(公告)日:2001-10-04
  • US6281363B1
    申请人:——
    公开号:US6281363B1
    公开(公告)日:2001-08-28
  • [EN] CYCLIC HYDRAZINE DERIVATIVES AS TNF-ALPHA INHIBITORS<br/>[FR] DERIVES CYCLIQUES DE L'HYDRAZINE COMME INHIBITEURS TNF-ALPHA
    申请人:HOFFMANN LA ROCHE
    公开号:WO2000035885A1
    公开(公告)日:2000-06-22
    Hydrazine derivatives of formula (I) wherein W represents O, S, CO, NR?5, (CR3R4)¿m, or CR11; X represents CO, NR6, (CH2)n, CR?12 or CHR13¿; Y represents CO, NR7, (CH2)p, or CHR14; Z represents CO, CS, SO¿2?, or CH2; m stands for 0 or 1; n and p each individually stand for 0, 1, or 2; R?1¿ represents lower alkyl, lower alkenyl, lower cycloalkyl, lower cycloalkyl-lower alkyl, aryl or aryl-lower alkyl; R2 represents lower alkyl, lower alkenyl, lower cycloalkyl, lower cycloalkyl-lower alkyl or a group of the formula V-aryl, V-heterocyclyl or -(CH¿2?)q-CH=CR?8R9; R3, R4, R5, R6 and R7¿ each independently represent hydrogen, optionally substituted lower alkyl, lower alkenyl, lower cycloalkyl, lower cycloalkyl-lower alkyl, aryl, aryl-lower alkyl, heterocyclyl or heterocyclyl-lower alkyl; or R?3 and R4¿ together with the carbon atom to which they are attached form a 3- to 8-membered ring; or R?5 and R6 or R5 and R7¿ together with the nitrogen atoms to which they are attached form a 3- to 8-membered ring; or R?11 and R12¿ together with the sp2 carbon atoms to which they are attached form a fused lower cycloalkenyl, aryl or heteroaryl ring; or R5 with either R?13 or R14¿ together represent lower alkylene in which a CH¿2? group is optionally replaced by a heteroatom; or either R?6 or R7¿ with either R3 or R4 together represent lower alkylene in which a CH¿2? group is optionally replaced by a heteroatom; or R?3 and R4¿ together represent lower alkylene in which a CH¿2? group is optionally replaced by a heteroatom; V represents a spacer group; R?8 and R9¿ together represent lower alkylene in which a CH¿2? group is optionally replaced by a heteroatom; and q stands for 1 or 2; with the provisos that (i) at least one of W, X and Y represents one of the heteroatoms previously indicated for these substituents or CO, (ii) Z represents CO or SO2 or CS when W represents O; (iii) W, X, Y and Z are not all CO and (iv) W, X and Y are not all NR?5, NR6 and NR7¿, respectively; and pharmaceutically acceptable salts thereof inhibit the release of tumour necrosis factor alpha (TNF-α) from cells. They can be used as medicaments, especially in the treatment of inflammatory and autoimmune diseases, osteoarthritis, respiratory diseases, tumours, cachexia, cardiovascular diseases, fever, haemorrhage and sepsis.
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