1-氯-4-异氰酰基丁烷 | 42865-18-9

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 1-氯-4-异氰酰基丁烷
• 英文名称: 4-chlorobutyl isocyanate
• 英文别名: 4-chloro-butyl isocyanate；4-Chlor-butylisocyanat；1-Chloro-4-isocyanatobutane
• CAS: 42865-18-9
• 化学式: C₅H₈ClNO
• 分子量: 133.578
• InChiKey: DLOJFZYDDGVUCK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  8
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  29.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-氯-4-异氰酰基丁烷 以 二氯甲烷 为溶剂， 反应 4.0h， 生成 2,3,4,5-tetrahydro<1,3>diazepino<1,2-c>quinazolin-7(8H)-one
  参考文献：
  名称：

  Kamal, Ahmed; Reddy, Narendra A. V.; Sattur, Prahlad B., Heterocycles, 1987, vol. 26, # 3, p. 751 - 754

  摘要：

  DOI：
• 作为产物：
  描述：

  光气 、 alkaline earth salt of/the/ methylsulfuric acid 在 1-氯萘 作用下， 生成 1-氯-4-异氰酰基丁烷
  参考文献：
  名称：

  Siefken, Justus Liebigs Annalen der Chemie, 1949, vol. 562, p. 75,1114

  摘要：

  DOI：

文献信息

• [EN] NEW (POLY)AMINOALKYLAMINOALKYLAMIDE, ALKYL-UREA, OR ALKYL-SULFONAMIDE DERIVATIVES OF EPIPODOPHYLLOTOXIN, A PROCESS FOR PREPARING THEM, AND APPLICATION THEREOF IN THERAPY AS ANTICANCER AGENTS<br/>[FR] NOUVEAU DÉRIVÉS (POLY)AMINOALKYLAMINOALKYLAMIDE, ALKYLE-URÉE, OU ALKYLE-SULFONAMIDE DE EPIPODOPHYLLOTOXINE, PROCÉDÉ PERMETTANT DE LES PRÉPARER ET APPLICATION DE CEUX-CI À DES FINS THÉRAPEUTIQUES EN TANT QU'AGENTS ANTICANCÉREUX
  申请人：PF MEDICAMENT

  公开号：WO2010020663A1

  公开（公告）日：2010-02-25

  The present invention relates to new derivatives of epipodophyllotoxin 4-substituted with an optionally substituted (poly)aminoalkylaminoalkylamidc, or alkyl-urea or alkyl- sulfonamide chain, a process for preparing them and their use as a medicine as an anticancer agent. Formula (1) wherein: - R represents hydrogen or C1-4alkyI, - A represents CO(CH2)n or CONH(CH2)n where n = 2, 3, 4, or 5, - R1 and R2 are as described herein.

  本发明涉及新的表现为选择性取代的环毒毒草素4-衍生物，其与（多）氨基烷基氨基烷基酰胺、烷基脲或烷基磺酰胺链取代，以及制备它们的过程和它们作为抗癌剂药物的用途。公式（1）中：- R代表氢或C1-4烷基，- A代表CO(CH2)n或CONH(CH2)n，其中n = 2、3、4或5，- R1和R2如本文所述。
• Azabicycloalkane derivatives and therapeutic uses thereof
  申请人：——

  公开号：US20020052355A1

  公开（公告）日：2002-05-02

  The present invention is directed to a compound of the formula (I): 1 and pharmaceutically acceptable salts thereof, wherein R 1 , R 2 , Y, U, W, k, A, E, V, R 4 and R 5 are as defined herein, pharmaceutical compositions thereof, and methods of use thereof in the inhibition of serotonin reuptake, the inhibition of the binding of 5-HT 2A serotonin receptors and the treatment of diseases, conditions or disorders of the central nervous system. Further, the present invention is also directed to methods for the preparation of compounds of formula (I) and intermediates useful therefor.

  本发明涉及一种化合物，其化学式为(I):1及其药学上可接受的盐，其中R1、R2、Y、U、W、k、A、E、V、R4和R5如本文所定义，以及其药物组成物，以及在抑制5-羟色胺再摄取、抑制5-HT2A受体结合和治疗中枢神经系统疾病、症状或障碍中的使用方法。此外，本发明还涉及化合物(I)的制备方法和相关中间体的方法。
• (POLY) AMINOALKYLAMINOALKYLAMIDE, ALKYL-UREA, OR ALKYL-SULFONAMIDE DERIVATIVES OF EPIPODOPHYLLOTOXIN, A PROCESS FOR PREPARING THEM, AND APPLICATION THEREOF IN THERAPY AS ANTICANCER AGENTS
  申请人：Imbert Thierry

  公开号：US20110172257A1

  公开（公告）日：2011-07-14

  The present invention relates to new derivatives of epipodophyllotoxin 4-substituted with an optionally substituted (poly)aminoalkylaminoalkylamide, or alkyl-urea or alkyl-sulfonamide chain, a process for preparing them and their use as a medicine as an anticancer agent. Formula (1) wherein: —R represents hydrogen or C 1-4 alkyl, —A represents CO(CH 2 ) n or CONH(CH 2 ) n where n=2, 3, 4, or 5, —R1 and R2 are as described herein.

  本发明涉及新的表嫩皮杜青毒素4-取代物，其与可选取代的（聚）氨基烷基氨基烷酰胺、烷基脲或烷基磺酰胺链相结合，制备过程以及它们作为一种抗癌药物的用途。其中，公式（1）中：-R代表氢或C1-4烷基，-A代表CO(CH2)n或CONH(CH2)n，其中n=2，3，4或5，-R1和R2如此处所述。
• NEW (POLY)AMINOALKYLAMINOALKYLAMIDE, ALKYL-UREA, OR ALKYL-SULFONAMIDE DERIVATIVES OF EPIPODOPHYLLOTOXIN, A PROCESS FOR PREPARING THEM, AND APPLICATION THEREOF IN THERAPY AS ANTICANCER AGENTS
  申请人：IMBERT Thierry

  公开号：US20120283281A1

  公开（公告）日：2012-11-08

  The present invention relates to new derivatives of epipodophyllotoxin 4-substituted with an optionally substituted (poly)aminoalkylaminoalkylamide, or alkyl-urea or alkyl-sulfonamide chain, a process for preparing them and their use as a medicine as an anticancer agent.

  本发明涉及新的表现为4-取代的环孢草毒素衍生物，其可选地被取代的（聚）氨基烷基氨基烷酰胺，或烷基脲或烷基磺酰胺链所取代，制备它们的过程以及将它们用作药物作为抗癌剂的用途。
• Thienopyrimidine-2,4-dione derivatives and intermediates thereof
  申请人：ORTHO PHARMACEUTICAL CORPORATION

  公开号：EP0244176A2

  公开（公告）日：1987-11-04

  The synthesis of thienopyrimidine-2,4-dione derivatives and their urea intermediates is described. The novel urea intermediates and thienopyrimidine-2,4-dione derivatives are general vasodilating agents and anti-hypertensive agents. The compounds are useful as cardiovascular agents.

  介绍了噻吩嘧啶-2,4-二酮衍生物及其脲中间体的合成。新型脲中间体和噻吩嘧啶-2,4-二酮衍生物是一般的血管扩张剂和抗高血压剂。这些化合物可用作心血管药物。