Propanenitrile, 3,3'-[1,4-butanediylbis(methylimino)]bis- | 61345-88-8

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: Propanenitrile, 3,3'-[1,4-butanediylbis(methylimino)]bis-
• 英文别名: 3-[4-[2-cyanoethyl(methyl)amino]butyl-methylamino]propanenitrile
• CAS: 61345-88-8
• 化学式: C₁₂H₂₂N₄
• 分子量: 222.333
• InChiKey: IYKSPADYHLDFAZ-UHFFFAOYSA-N

物化性质

• 沸点：
  394.5±22.0 °C(Predicted)
• 密度：
  0.975±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.4
• 重原子数：
  16
• 可旋转键数：
  9
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  54.1
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  Propanenitrile, 3,3'-[1,4-butanediylbis(methylimino)]bis- 在 氢气 作用下， 以 乙醇 为溶剂， 生成 N1,N1'-(丁烷-1,4-二基)双(N1甲基丙烷-1,3-二胺)
  参考文献：
  名称：

  An improved total synthesis of spermatinamine, an inhibitor of isoprenylcysteine carboxy methyltransferase

  摘要：

  An improved total synthesis of spermatinamine, an inhibitor of the anticancer target, isoprenylcysteine carboxy methyltransferase (Icmt) was accomplished from the commercially available 3,4-dibromo-4-hydroxybenzaldehyde via a high yielding reaction sequence in an overall yield of 31%. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.10.164
• 作为产物：
  描述：

  N,N'-二甲基-1,4-丁二胺 、 丙烯腈 以 乙醇 为溶剂， 生成 Propanenitrile, 3,3'-[1,4-butanediylbis(methylimino)]bis-
  参考文献：
  名称：

  An improved total synthesis of spermatinamine, an inhibitor of isoprenylcysteine carboxy methyltransferase

  摘要：

  An improved total synthesis of spermatinamine, an inhibitor of the anticancer target, isoprenylcysteine carboxy methyltransferase (Icmt) was accomplished from the commercially available 3,4-dibromo-4-hydroxybenzaldehyde via a high yielding reaction sequence in an overall yield of 31%. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.10.164

文献信息

• TRANSFECTION REAGENTS
  申请人：LIFE TECHNOLOGIES CORPORATION

  公开号：US20150190522A1

  公开（公告）日：2015-07-09

  Disclosed are compounds capable of facilitating transport of biologically active agents or substances into cells having the general structure: wherein Q is selected from the group consisting of N, O and S; L is any bivalent organic radical capable of linking each Q, such as C, CH, (CH 2 ) l , or (CH 2 ) i —Y—(CH 2 ) j } k , wherein Y is selected from the group consisting of CH 2 , an ether, a polyether, an amide, a polyamide, an ester, a sulfide, a urea, a thiourea, a guanidyl, a carbamoyl, a carbonate, a phosphate, a sulfate, a sulfoxide, an imine, a carbonyl, and a secondary amino group and wherein Y is optionally substituted by —X 1 -L′-X 2 —Z or —Z; R 1 R 6 , independently of one another, are selected from the group consisting of H, —(CH 2 ) p -D-Z, an alkyl, an alkenyl, an aryl, and an alkyl or alkyl ether optionally substituted by one or more of an alcohol, an aminoalcohol, an amine, an amide, an ether, a polyether, a polyamide, an ester, a mercaptan, an alkylthio, a urea, a thiourea, a guanidyl, or a carbamoyl group, and wherein at least one of R 1 , R 3 , R 4 and R 6 is a straight chain or branched, cyclic, alkyl, alkenyl, alkynyl or aryl group; and anyone of R 1 , R 3 , R 4 and/or R 6 may optionally be covalently linked with each other, with Y or with L when L is C or CH to form a cyclic moiety; Z is selected from the group consisting of amine, spermiyl, carboxyspermiyl, guanidyl, spermidinyl, putricinyl, diaminoalkyl, pyridyl, piperidinyl, pyrrolidinyl, polyamine, amino acid, peptide, and protein; X 1 and X 2 , independently of one another, are selected from the group consisting of NH, O, S, alkylene, and arylene; L′ is selected from the group consisting of alkylene, alkenylene, alkynylene, arylene, alkylene ether, and polyether; D is Q or a bond; A 1 and A 2 , independently of one another, are selected from the group consisting of CH 2 O, CH 2 S, CH 2 NH, C(O), C(NH), C(S) and (CH 2 )t; X is a physiologically acceptable anion; m, n, r, s, u, v, w and y are 0 or 1, with the proviso that when both m and n are 0 at least one of r, s, u and y is other than 0; i, j, k, l, p and are integers from 0 to about 100; q is an integer from 1 to about 1000; and a is the number of positive charge divided by the valence of the anion.
• US9358300B2
  申请人：——

  公开号：US9358300B2

  公开（公告）日：2016-06-07
• An improved total synthesis of spermatinamine, an inhibitor of isoprenylcysteine carboxy methyltransferase
  作者：Nisar Ullah、Shamsuddeen A. Haladu、Basem A. Mosa

  DOI：10.1016/j.tetlet.2010.10.164

  日期：2011.1

  An improved total synthesis of spermatinamine, an inhibitor of the anticancer target, isoprenylcysteine carboxy methyltransferase (Icmt) was accomplished from the commercially available 3,4-dibromo-4-hydroxybenzaldehyde via a high yielding reaction sequence in an overall yield of 31%. (C) 2010 Elsevier Ltd. All rights reserved.