N-(2-cyclopentyloxypyridin-3-ylsulfonyl)-N'-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: N-(2-cyclopentyloxypyridin-3-ylsulfonyl)-N'-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea
• 英文别名: 1-(2-cyclopentyloxypyridin-3-yl)sulfonyl-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea
• 化学式: C₁₆H₂₀N₆O₅S
• 分子量: 408.438
• InChiKey: DDHMROYEOJCHAP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  28
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  154
• 氢给体数：
  2
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  2-cyclopentyloxypyridin-3-ylsulfonamide 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 、 4-Methoxy-6-methyl-1,3,5-triazin-2-ylphenylcarbamate 在 盐酸 、 乙醚 、 水 作用下， 以 1,4-二氧六环 为溶剂， 反应 0.5h， 以affording 7.79 g of N-(2-cyclopentyloxypyridin-3-ylsulfonyl)-N'-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea with a melting point of 170°-172° C.的产率得到N-(2-cyclopentyloxypyridin-3-ylsulfonyl)-N'-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea
  参考文献：
  名称：

  Herbicidal sulfonylureas

  摘要：

  通式为##STR1##的取代的N-芳基磺酰-N'-嘧啶基脲和N-芳基磺酰-N'-三嗪基脲，其中R.sup.1是##STR2##，R.sup.2是氢、卤素、硝基、C.sub.1-C.sub.3烷基、C.sub.1-C.sub.3烷氧基或--COOR.sup.9，R.sup.3是氢、C.sub.1-C.sub.3烷基或C.sub.1-C.sub.3烷氧基，R.sup.4和R.sup.5各自独立于另一个，是氢、卤素、C.sub.1-C.sub.4烷基、C.sub.1-C.sub.4卤代烷基、C.sub.1-C.sub.4烷氧基、C.sub.1-C.sub.4卤代烷氧基、C.sub.1-C.sub.4烷硫基、C.sub.1-C.sub.4卤代烷硫基、C.sub.2-C.sub.4烷氧基烷基、C.sub.3-C.sub.6环烷基或--NR.sup.10 R.sup.11，R.sup.6是氢或C.sub.1-C.sub.3烷基，R.sup.7是氢或甲基，R.sup.8是C.sub.4-C.sub.6环戊酰基，未取代或被C.sub.1-C.sub.3烷基或卤素取代；C.sub.3-C.sub.6环烷基，未取代或被一个或多个相同或不同的成员所取代，所述成员选自C.sub.1-C.sub.3烷基、C.sub.1-C.sub.3烷氧基、卤素或氰基；或为C.sub.5-C.sub.6环烯基，未取代或被C.sub.1-C.sub.3烷基、卤素或氰基取代，R.sup.9是C.sub.1-C.sub.3烷基或烯丙基，R.sup.10和R.sup.11各自独立于另一个，是氢或C.sub.1-C.sub.4烷基，n为0或1，X为硫或氧，E和Z各自独立于另一个，是氮或甲基桥，但R.sup.8仅为未取代或被取代的C.sub.3-C.sub.6环烷基，如果同时Z为氮，则这些化合物的盐与胺、碱金属基或碱土金属基的混合物具有良好的前草和后草选择性除草和生长调节特性。

  公开号：

  US04778513A1

文献信息

• Herbicidal sulfonylureas
  申请人：Ciba-Geigy Corporation

  公开号：US04643760A1

  公开（公告）日：1987-02-17

  Substituted N-arylsulfonyl-N'-pyrimidinylureas and N-arylsulfonyl-N'-triazinylureas of the general formula ##STR1## wherein R.sup.1 is a ##STR2## R.sup.2 is hydrogen, halogen, nitro, C.sub.1 -C.sub.3 alkyl, C.sub.1 -C.sub.3 alkoxy or --COOR.sup.9, R.sup.3 is hydrogen, C.sub.1 -C.sub.3 alkyl or C.sub.1 -C.sub.3 alkoxy, R.sup.4 and R.sup.5 are each independently of the other hydrogen, halogen, C.sub.1 -C.sub.4 alkyl, C.sub.1 -C.sub.4 haloalkyl, C.sub.1 -C.sub.4 alkoxy, C.sub.1 -C.sub.4 haloalkoxy, C.sub.1 -C.sub.4 alkylthio, C.sub.1 -C.sub.4 haloalkylthio, C.sub.2 -C.sub.4 alkoxyalkyl, C.sub.3 -C.sub.6 -cycloalkyl or --NR.sup.10 R.sup.11, R.sup.6 is hydrogen or C.sub.1 -C.sub.3 alkyl, R.sup.7 is hydrogen or methyl, R.sup.8 is C.sub.4 -C.sub.6 cycloalkanonyl which is unsubstituted or substituted by C.sub.1 -C.sub.3 alkyl or halogen; C.sub.3 -C.sub.6 cycloalkyl which is unsubstituted or substituted by one or more identical or different members selected from the group consisting of C.sub.1 -C.sub.3 alkyl, C.sub.1 -C.sub.3 alkoxy, halogen or cyano; or is C.sub.5 -C.sub.6 cycloalkenyl which is unsubstituted or substituted by C.sub.1 -C.sub.3 alkyl, halogen or cyano, R.sup.9 is C.sub.1 -C.sub.3 alkyl or allyl, R.sup.10 and R.sup.11 are each independently of the other hydrogen or C.sub.1 -C.sub.4 alkyl, n is 0 or 1, X is sulfur or oxygen, and E and Z are each independently of the other nitrogen or the methine bridge, with the proviso that R.sup.8 is only unsubstituted or substituted C.sub.3 -C.sub.6 cycloalkyl if at the same time Z is nitrogen, and the salts of these compounds with amines, alkali metal bases or alkaline earth metal bases, have good pre- and postemergence selective herbicidal and growth regulating properties.

  通式为##STR1##其中，R.sup.1为##STR2##R.sup.2为氢、卤素、硝基、C.sub.1-C.sub.3烷基、C.sub.1-C.sub.3烷氧基或--COOR.sup.9，R.sup.3为氢、C.sub.1-C.sub.3烷基或C.sub.1-C.sub.3烷氧基，R.sup.4和R.sup.5各自独立地为氢、卤素、C.sub.1-C.sub.4烷基、C.sub.1-C.sub.4卤代烷基、C.sub.1-C.sub.4烷氧基、C.sub.1-C.sub.4卤代烷氧基、C.sub.1-C.sub.4烷硫基、C.sub.1-C.sub.4卤代烷硫基、C.sub.2-C.sub.4烷氧基烷基、C.sub.3-C.sub.6环烷基或--NR.sup.10R.sup.11，R.sup.6为氢或C.sub.1-C.sub.3烷基，R.sup.7为氢或甲基，R.sup.8为未取代或取代的C.sub.4-C.sub.6环己酰基，所述取代基为C.sub.1-C.sub.3烷基或卤素；未取代或取代的C.sub.3-C.sub.6环烷基，所述取代基为选自C.sub.1-C.sub.3烷基、C.sub.1-C.sub.3烷氧基、卤素或氰基的一个或多个相同或不同成员；或为未取代或取代的C.sub.5-C.sub.6环烯基，所述取代基为C.sub.1-C.sub.3烷基、卤素或氰基，R.sup.9为C.sub.1-C.sub.3烷基或烯丙基，R.sup.10和R.sup.11各自独立地为氢或C.sub.1-C.sub.4烷基，n为0或1，X为硫或氧，E和Z各自独立地为氮或甲基桥，但是当Z为氮时，R.sup.8仅为未取代或取代的C.sub.3-C.sub.6环烷基，这些化合物的胺、碱金属基或碱土金属基的盐具有良好的前、后除草和生长调节性能。
• Pyridylsulfonamides
  申请人：Ciba-Geigy Corporation

  公开号：US04923995A1

  公开（公告）日：1990-05-08

  Substituted N-arylsulfonyl-N'-pyrimidinylureas and N-arylsulfonyl-N'-triazinylureas of the general formula ##STR1## wherein R.sup.1 is a ##STR2## radical, R.sup.2 is hydrogen, halogen, nitro, C.sub.1 -C.sub.3 alkyl, C.sub.1 -C.sub.3 alkoxy or --COOR.sup.9, R.sup.3 is hydrogen, C.sub.1 -C.sub.3 alkyl or C.sub.1 -C.sub.3 alkoxy, R.sup.4 and R.sup.5 are each independently of the other hydrogen, halogen, C.sub.1 -C.sub.4 alkyl, C.sub.1 -C.sub.4 haloalkyl, C.sub.1 -C.sub.4 alkoxy, C.sub.1 -C.sub.4 haloalkoxy, C.sub.1 -C.sub.4 alkylthio, C.sub.1 -C.sub.4 haloalkylthio, C.sub.2 -C.sub.4 alkoxyalkyl, C.sub.3 -C.sub.6 cycloalkyl or --NR.sup.10 R.sup.11, R.sup.6 is hydrogen or C.sub.1 -C.sub.3 alkyl, R.sup.7 is hydrogen or methyl, R.sup.8 is C.sub.4 -C.sub.6 cycloalkanonyl which is unsubstituted or substituted by C.sub.1 -C.sub.3 alkyl or halogen; C.sub.3 -C.sub.6 cycloalkyl which is unsubstituted or substituted by one or more identical or different members selected from the group consisting of C.sub.1 -C.sub.3 alkyl, C.sub.1 -C.sub.3 alkoxy, halogen or cyano; or is C.sub.5 -C.sub.6 cycloalkenyl which is unsubstituted or substituted by C.sub.1 -C.sub.3 alkyl, halogen or cyano, R.sup.9 is C.sub.1 -C.sub.3 alkyl or allyl, R.sup.10 and R.sup.11 are each independently of the other hydrogen or C.sub.1 -C.sub.4 alkyl, n is 0 or 1, X is sulfur or oxygen, and E and Z are each independently of the other nitrogen or the methine bridge, with the proviso that R.sup.8 is only unsubstituted or substituted C.sub.3 -C.sub.6 cycloalkyl if at the same time Z is nitrogen, and the salts of these compounds with amines, alkali metal bases or alkaline earth metal bases, have good pre- and postemergence selective herbicidal and growth regulating properties.

  通式为##STR1##的取代的N-芳基磺酰基-N'-嘧啶基脲和N-芳基磺酰基-N'-三嗪基脲，其中R.sup.1是一个##STR2##基团，R.sup.2是氢，卤素，硝基，C.sub.1-C.sub.3烷基，C.sub.1-C.sub.3烷氧基或--COOR.sup.9，R.sup.3是氢，C.sub.1-C.sub.3烷基或C.sub.1-C.sub.3烷氧基，R.sup.4和R.sup.5各自独立地是氢，卤素，C.sub.1-C.sub.4烷基，C.sub.1-C.sub.4卤代烷基，C.sub.1-C.sub.4烷氧基，C.sub.1-C.sub.4卤代烷氧基，C.sub.1-C.sub.4烷硫基，C.sub.1-C.sub.4卤代烷硫基，C.sub.2-C.sub.4烷氧基烷基，C.sub.3-C.sub.6环烷基或--NR.sup.10 R.sup.11，R.sup.6是氢或C.sub.1-C.sub.3烷基，R.sup.7是氢或甲基，R.sup.8是C.sub.4-C.sub.6环己酰基，未取代或被C.sub.1-C.sub.3烷基或卤素取代; C.sub.3-C.sub.6环烷基，未取代或被一个或多个相同或不同的成员所取代，所述成员选自C.sub.1-C.sub.3烷基，C.sub.1-C.sub.3烷氧基，卤素或氰基; 或者是未取代或被C.sub.1-C.sub.3烷基，卤素或氰基取代的C.sub.5-C.sub.6环烯基，R.sup.9是C.sub.1-C.sub.3烷基或烯丙基，R.sup.10和R.sup.11各自独立地是氢或C.sub.1-C.sub.4烷基，n为0或1，X为硫或氧，E和Z各自独立地是氮或甲基桥，但R.sup.8仅在Z为氮时未取代或取代C.sub.3-C.sub.6环烷基，这些化合物与胺，碱金属基或碱土金属基的盐具有良好的前期和后期选择性除草和生长调节性能。
• Herbizide Sulfonylharnstoffe
  申请人：CIBA-GEIGY AG

  公开号：EP0145664B1

  公开（公告）日：1988-04-27
• US4643760A
  申请人：——

  公开号：US4643760A

  公开（公告）日：1987-02-17
• US4778513A
  申请人：——

  公开号：US4778513A

  公开（公告）日：1988-10-18