1,2,3-苯并噻二唑-7-甲酰氯 | 124371-49-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并噻二唑类
• 中文名称: 1,2,3-苯并噻二唑-7-甲酰氯
• 中文别名: 氨基甲硫酸,N-[[2-[[4-羟基-3-[[[2-(十四烷氧基)苯基]氨基]羰基]-1-萘基]氧代]-5-硝基苯基]甲基]-N-(1-甲基乙基)-,S-(1-苯基-1H-四唑-5-基)酯
• 英文名称: benzo-1,2,3-thiadiazole-7-carboxylic acid chloride
• 英文别名: benzo[1,2,3]thiadiazole-7-carbonyl chloride；benzo[d][1,2,3]thiadiazol-7-carboxylic chloride；benzo[d][1,2,3]thiadiazole-7-carbonyl chloride；benzothiadiazole-7-carboxylic acid chloride；7-chlorocarbonyl-1,2,3-benzothiadiazole；1,2,3-Benzothiadiazole-7-carbonyl chloride
• CAS: 124371-49-9
• 化学式: C₇H₃ClN₂OS
• 分子量: 198.633
• InChiKey: FHWNOXLHRUSQMV-UHFFFAOYSA-N

物化性质

• 沸点：
  311.0±34.0 °C(Predicted)
• 密度：
  1.577±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  12
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  71.1
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  乙二醇水杨酸酯 、 1,2,3-苯并噻二唑-7-甲酰氯 在 三乙胺 作用下， 以 甲苯 为溶剂， 生成 benzo-1,2,3-thiadiazole-7-carboxylic acid 2-(2-hydroxybenzoyloxy)ethyl ester
  参考文献：
  名称：

  Derivatives of benzothiadiazole-7-carboxylates: synthesis and biological activity

  摘要：

  Salicylic acid (SA) and methyl jasmonate (MJ) are important plant signal molecules to cause systemic acquired resistance (SAR), while it's reported that they also have wide spectrum antitumor activities. Benzothiadiazole-7-carboxylates are plant activators which can cause SAR just like SA and MJ. To investigate whether the benzothiadiazole-7-carboxylate family is endowed with anticancer activities, several benzothiadiazole-7-carboxylate derivatives are synthesized and their inhibition to P388 murine leukemia cell and A549 human lung cancer cell compared with MJ are evaluated. The data indicated that benzo-1,2,3-thiadiazole-7-carboxylic acid 2-benzoyloxyethyl ester has a higher inhibition ability to the cancer cell P388 and A549, compared with MJ.

  DOI：

  10.1007/s00706-008-0887-3
• 作为产物：
  描述：

  2-氯-3,5-二硝基苯甲酸 在 镍 sodium hydroxide 、 氯化亚砜 、 水 、 氢气 、 氢气 、 potassium carbonate 、 sodium nitrite 作用下， 以 四氢呋喃 、 N,N-二甲基甲酰胺 为溶剂， 生成 1,2,3-苯并噻二唑-7-甲酰氯
  参考文献：
  名称：

  The Chemistry of Benzothiadiazole Plant Activators

  摘要：

  DOI：

  10.1002/(sici)1096-9063(199708)50:4<275::aid-ps593>3.0.co;2-7

文献信息

• 一种酰胺类化合物及其制备方法和用途
  申请人：上海泰禾国际贸易有限公司

  公开号：CN108383791A

  公开（公告）日：2018-08-10

  本发明提供了一种酰胺类化合物及其制备方法和用途，所述酰胺类化合物具有如下式I所示的结构，其是一种新型的杀菌剂，可应用于农业、林业上病虫害的防治，具有良好的防治效果，尤其对大豆锈病、黄瓜霜霉病和黄瓜白粉病具有很好的防治效果，在酰胺类化合物浓度为100ppm时，对于大豆锈病的防效在80％以上；在酰胺类化合物浓度为400ppm时，对于黄瓜霜霉病的防效在80％以上，对于黄瓜白粉病防效在90％以上。并且其制备方法简单高效、易于规模化生产，应用前景广泛。
• Process and a composition for immunizing plants against diseases
  申请人：Ciba-Geigy Corporation

  公开号：US04931581A1

  公开（公告）日：1990-06-05

  A method and composition for the immunization of healthy useful plants against plant diseases containing as active ingredients compounds of formula ##STR1## in which: X is hydrogen, halogen, hydroxy, methyl, methoxy, HOOC or MOOC; Y is hydrogen, halogen, SO.sub.3 H, SO.sub.3 M, nitro, hydroxy or amino, M being the molar equivalent of an alkali metal or alkaline earth metal ion that is formed from a corresponding base or basic compound; and Z is cyano or --CO--A; A represents either --OH or --SH, the hydrogen atom of which may also be replaced by the molar equivalent of an inorganic or organic cationic residue, or wherein A represents any other organic residue which has a molecular weight of less than 900 and which may also contain one, or more than one, hetero atom, including the salts of the phytophysiologically tolerable 7-carboxylic acid or 7-thiocarboxylic acid with primary, secondary or tertiary amines or with inorganic bases.

  一种用于对健康有益的植物进行免疫接种以防止植物病害的方法和组合物，其中活性成分是公式##STR1##的化合物，其中：X是氢、卤素、羟基、甲基、甲氧基、羧基或甲氧羧基；Y是氢、卤素、磺酸基、甲磺酸基、硝基、羟基或氨基，M是一个碱金属或碱土金属离子的摩尔当量，该金属离子由相应的碱或碱性化合物形成；Z是氰基或--CO--A；A代表--OH或--SH，其中的氢原子也可以被无机或有机阳离子残基的摩尔当量所取代，或者其中A代表任意的其它有机残基，其分子量小于900，并且也可以包含一个或多个杂原子，包括与初级、次级或三级胺或无机碱形成的植物生理上可容忍的7-羧酸或7-硫羧酸的盐。
• 苯并[1,2,3]噻二唑-7-羧酸酯衍生物作为植 物抗病激活剂的应用
  申请人：华东理工大学

  公开号：CN102532058B

  公开（公告）日：2016-11-09

  发明涉及式(I)所示的苯并[1，2，3]噻二唑‑7‑羧酸酯衍生物作为植物抗病激活剂的应用。该系列化合物对植物的多种疾病具有一定的防治效果。
• ß-CARBOLINE, DIHYDRO-ß-CARBOLINE AND TETRAHYDRO-ß-CARBOLINE ALKALOID DERIVATIVES AND PREPARATION METHODS SAME AND USE IN ASPECTS OF PREVENTING AND TREATING PLANT VIRUSES, FUNGICIDES AND INSECTICIDES
  申请人：NANKAI UNIVERSITY

  公开号：US20160326166A1

  公开（公告）日：2016-11-10

  The present invention relates to β-carboline, dihydro-β-carboline and tetrahydro-β-carboline alkaloid derivatives (I) and a method for preparing same and the use in the aspects of preventing and treating plant viruses, fungicides and insecticides. For the meaning of each group in formula (I) see the description. The β-carboline, dihydro-β-carboline and tetrahydro-β-carboline alkaloid derivatives of the present invention show a particularly ourstanding anti-plant virus activity, and also have fungicidal and insecticidal activities.

  本发明涉及β-咔啉、二氢β-咔啉和四氢β-咔啉生物碱衍生物(I)，以及其制备方法和在预防和治疗植物病毒、杀菌剂和杀虫剂方面的用途。本发明中的β-咔啉、二氢β-咔啉和四氢β-咔啉生物碱衍生物显示出特别出色的抗植物病毒活性，同时还具有杀菌和杀虫活性。
• 3-amino-2-mercaptobenzoic acid derivatives and processes for their
  申请人：Novartis Corporation

  公开号：US05770758A1

  公开（公告）日：1998-06-23

  Compounds of the formula I ##STR1## and disulfides thereof and salts thereof are important intermediate products for the preparation of compounds having a microbicidal and plant-immunizing action, of the formula III ##STR2## In the compounds of the formulae I and III: X is halogen, n is 0,1,2 or 3; Z is CN, CO-A or CS-A, A is hydrogen, halogen, OR.sub.1, SR.sub.2 and N(R.sub.3)R.sub.4 ; R.sub.1 to R .sub.4 are hydrogen, a substituted or unsubstituted, open-chain, saturated or unsaturated hydrocarbon radical containing not more than 8 carbon atoms, a substituted or unsubstituted cyclic, saturated or unsaturated hydrocarbon radical containing not more than 10 carbon atoms, substituted or unsubstituted benzyl or phenethyl, a substituted or unsubstituted alkanoyl group containing not more than 8 carbon atoms, a substituted or unsubstituted benzoyl group or a substituted or unsubstituted heterocyclyl radical; or R.sub.3 and R.sub.4, together with the nitrogen atom to which they are bonded, are a 5- or 6-membered, substituted or unsubstituted heterocyclic radical having 1-3 heteroatoms O,S and/or N. Processes for the preparation of compounds of the formula I are described.

  公式I ##STR1## 的化合物及其二硫化物和盐是制备具有抗微生物和植物免疫作用的化合物的重要中间体，公式III ##STR2## 在公式I和III的化合物中：X是卤素，n为0,1,2或3；Z是CN，CO-A或CS-A，A是氢，卤素，OR.sub.1，SR.sub.2和N（R.sub.3）R.sub.4；R.sub.1到R .sub.4是氢，含有不超过8个碳原子的取代或未取代的开链、饱和或不饱和碳氢基团，含有不超过10个碳原子的取代或未取代的环状、饱和或不饱和碳氢基团，取代或未取代的苄基或苄基乙基，含有不超过8个碳原子的取代或未取代的烷酰基团，取代或未取代的苯甲酰基团或取代或未取代的杂环基团；或R.sub.3和R.sub.4，与它们结合的氮原子一起，是具有1-3个杂原子O、S和/或N的5-或6-成员取代或未取代的杂环基团。描述了公式I化合物的制备方法。