2-Chlor-4-methyl-5-propyl-thiazol | 31784-84-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-Chlor-4-methyl-5-propyl-thiazol
• 英文别名: 2-chloro-4-methyl-5-propyl-thiazole；Thiazole, 2-chloro-4-methyl-5-propyl-；2-chloro-4-methyl-5-propyl-1,3-thiazole
• CAS: 31784-84-6
• 化学式: C₇H₁₀ClNS
• 分子量: 175.682
• InChiKey: QMTUCXGJDRIQSH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  10
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  41.1
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• [EN] THERAPEUTICS TARGETING MUTANT ADENOMATOUS POLYPOSIS COLI (APC) FOR THE TREATMENT OF CANCER<br/>[FR] AGENTS THÉRAPEUTIQUES CIBLANT LA POLYPOSE ADÉNOMATEUSE COLIQUE (APC) MUTANTE POUR LE TRAITEMENT DU CANCER
  申请人：UNIV TEXAS

  公开号：WO2020117972A1

  公开（公告）日：2020-06-11

  The present disclosure reports an extensive medicinal chemistry evaluation of a large collection of Truncating APC-Selective Inhibitor (TASIN) compounds. The compounds were evaluated for activity against a series of colon cancer cell lines with and without truncating APC-mutations, as well as in an isogenic cell line pair reporting on the status of APC- dependent selectivity. A number of very potent and selective compounds were identified, including compounds with good metabolic stability and PK properties. The small molecules reported herein thus represent a first-in-class genotype-selective series that specifically target ape mutations present in the vast majority of CRC patients, and therefore serves as a translational platform towards a potential targeted therapy for colon cancer.

  本披露报告了对大量截断APC-选择性抑制剂（TASIN）化合物的广泛药物化学评估。这些化合物针对一系列结肠癌细胞系进行了活性评估，包括具有截断APC突变和不具有截断APC突变的细胞系，以及在报告APC依赖性选择性状况的同源细胞系对。鉴定了一些非常有效和选择性的化合物，包括具有良好代谢稳定性和药代动力学性质的化合物。因此，本文报道的小分子代表了一种首创的基因型选择性系列，专门针对存在于绝大多数结直肠癌患者中的猿类突变，因此可作为一个转化平台，朝着结肠癌的潜在靶向治疗迈进。
• MIXTURES OF MESOIONIC PESTICIDES
  申请人：Holyoke, JR. Caleb William

  公开号：US20120115722A1

  公开（公告）日：2012-05-10

  Disclosed are compositions comprising (a) at least one compound selected from compounds of Formula 1, N-oxides, and salt thereof, wherein R 1 is phenyl optionally substituted with up to 5 substituents independently selected from R 3 , or pyridinyl optionally substituted with up to 4 substituents independently selected from R 3 ; R 2 is C 1 -C 4 haloalkyl; or thiazolyl, pyridinyl or pyrimidinyl, each optionally substituted with up to 2 substituents independently selected from the group consisting of halogen and C 1 -C 4 alkyl; each R 3 is independently halogen, cyano, C 1 -C 4 alkyl, C 1 -C 4 haloalkyl, C 1 -C 4 alkoxy, C 1 -C 4 haloalkoxy, C(R 4 )═NOR 4 or Q; each R 4 is independently C 1 -C 4 alkyl; Z is CH═CH or S; and each Q is independently phenyl or pyridinyl, each optionally substituted with up to 3 substituents independently selected from the group consisting of halogen, cyano, C 1 -C 4 alkyl, C 1 -C 4 haloalkyl, C 1 -C 4 alkoxy and C 1 -C 4 haloalkoxy; and (b) at least one invertebrate pest control agent. Also disclosed are methods for controlling an invertebrate pest comprising contacting the invertebrate pest or its environment with a biologically effective amount of a composition of the invention.

  本发明涉及一种组合物，包括（a）至少一种选择自式1化合物，N-氧化物和其盐的化合物，其中R1是苯基，可选地取代最多5个独立选择自R3的取代基，或者是吡啶基，可选地取代最多4个独立选择自R3的取代基；R2是C1-C4卤代烷基；或噻唑基，吡啶基或嘧啶基，每个基可选地取代最多2个独立选择自卤素和C1-C4烷基的基团；每个R3是独立的卤素，氰基，C1-C4烷基，C1-C4卤代烷基，C1-C4烷氧基，C1-C4卤代烷氧基，C（R4）═NOR4或Q；每个R4是独立的C1-C4烷基；Z是CH═CH或S；每个Q是独立的苯基或吡啶基，可选地取代最多3个独立选择自卤素，氰基，C1-C4烷基，C1-C4卤代烷基，C1-C4烷氧基和C1-C4卤代烷氧基的基团；和（b）至少一种无脊椎动物害虫控制剂。本发明还涉及一种控制无脊椎动物害虫的方法，包括用本发明组合物的生物有效量接触无脊椎动物害虫或其环境。