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2-(3-chloropropoxy)benzamide | 39506-65-5

中文名称
——
中文别名
——
英文名称
2-(3-chloropropoxy)benzamide
英文别名
2-(2-bromoethoxy)benzamide
2-(3-chloropropoxy)benzamide化学式
CAS
39506-65-5
化学式
C10H12ClNO2
mdl
——
分子量
213.664
InChiKey
PZHSFVHXGQGGES-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    1.8
  • 重原子数:
    14
  • 可旋转键数:
    5
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.3
  • 拓扑面积:
    52.3
  • 氢给体数:
    1
  • 氢受体数:
    2

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量
    水杨酰胺 salicylamide 65-45-2 C7H7NO2 137.138
  • 下游产品
    中文名称 英文名称 CAS号 化学式 分子量
    —— 2-[3-(4-phenylpiperazin-1-yl)propoxy]benzamide 883021-16-7 C20H25N3O2 339.437
    —— 2-{3-[4-(2-methoxyphenyl) piperazin-1-yl]propoxy}benzamide 1010077-79-8 C21H27N3O3 369.464

反应信息

  • 作为反应物:
    描述:
    2-(3-chloropropoxy)benzamide2-[1-(phenylsulfonyl)-1H-indol-3-yl]ethanamines三乙胺 、 potassium iodide 作用下, 以 乙腈 为溶剂, 反应 8.0h, 以64%的产率得到3-(3-(2-(1-(phenylsulfonyl)-1H-indol-3-yl)ethylamino)propoxy)benzamide
    参考文献:
    名称:
    Effects of chronic mild stress on rats selectively bred for behavior related to bipolar disorder and depression
    摘要:
    To test the possibility that chronic mild stress (CMS) might be unreliable in producing its often-intended outcome (i.e., decreased preference for sucrose, hypothesized to represent depression-relevant anhedonia) because it is typically applied to "normal" rats, a CMS procedure was applied to rats that may possess genetic susceptibility to affective disorders, having had been selectively-bred to show behavior indicative of such disorders. These rat lines were: Hyperactive (HYPER) rats, which show characteristics of bipolar disorder, Swim-test Susceptible (SUS) and Swim-test Resistant (RES) rats, being susceptible or resistant to effects of stress in the swim test, Swim High-active (SwHi) and Swim Low-active (SwLo) rats, which innately show high or low activity in the swim test These selectively-bred lines were compared to normal, non-selectively bred (NS) rats. During CMS, HYPER rats, both females and males, as well as RES and SwHi rats, showed reduced consumption of a palatable 2% sucrose solution, and reduced preference for sucrose (vs. water) in comparison to non-stressed rats (no CMS) of the same lines. In contrast, CMS produced no decrease in sucrose consumption or in preference for sucrose in normal NS rats, and actually a caused a slight increase in sucrose consumption and preference in male NS rats. Other measures that indicate depression - food intake and motor activity in the home cage - were also assessed. SwLo and SwHi showed greater sensitivity to having their home-cage ambulatory activity reduced by CMS than did NS rats, but no other such differences relative to NS rats were seen for these other measures; thus, changes in sucrose intake or preference could not be explained by a change in caloric intake. These results suggest that the genetic attributes of animals can influence the outcome of CMS, and that the application of CMS to normal, non-selected rats may account, at least in part, for the unreliability of CMS in decreasing consumption of palatable substances and decreasing preference for such substances. (C) 2013 Published by Elsevier Inc.
    DOI:
    10.1016/j.physbeh.2013.05.042
  • 作为产物:
    描述:
    1-溴-3-氯丙烷水杨酰胺potassium carbonate 作用下, 以 乙腈 为溶剂, 反应 8.0h, 以42.18%的产率得到2-(3-chloropropoxy)benzamide
    参考文献:
    名称:
    Synthesis, computational studies, and preliminary pharmacological evaluation of new arylpiperazines as potential antipsychotics
    摘要:
    A series of long-chain arylpiperazines bearing a salicylamide fragment were synthesized, and the target compounds were evaluated for atypical antipsychotic activity in apomorphine-induced climbing behavior (D-2 antagonism) and 5-HTP-induced head twitches (5-HT2A antagonism) along with catalepsy studies in mice. The physicochemical similarity values of the target compounds with respect to standard drugs, clozapine, ketanserin, and risperidone, were determined using software programs. The test compounds demonstrated good similarity values with respect to the standard drugs. The compounds 3a (4) showed maximum atypical antipsychotic like profile.
    DOI:
    10.1007/s00044-011-9630-4
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文献信息

  • INDOLEAMINE DERIVATIVES FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES
    申请人:Kolaczkowski Marcin
    公开号:US20140121216A1
    公开(公告)日:2014-05-01
    Indoleamine derivatives of formula (IA), R 1 represents benzyl unsubstituted or substituted with halogen atom, —OH, or C 1 -C 3 -alkyl; phenylsulphonyl unsubstituted or substituted in the phenyl ring with halogen atom, —OH or C 1 -C 3 -alkyl; G 1 represents phenoxyalkyl, heteroaryloxyalkyl- or heterocyclyloxyalkyl-piperazine moiety; and pharmaceutically acceptable salts and solvates thereof. The compounds may be useful for the treatment and/or prevention of the central nervous system disorders.
    公式(IA)的吲哚胺衍生物,其中R1代表苄基未取代或取代为卤原子,-OH,或C1-C3-烷基;苯磺酰未取代或取代为苯环中的卤原子,-OH或C1-C3-烷基;G1代表苯氧基烷基,杂环氧基烷基-或杂环氧基烷基-哌嗪基;以及其药学上可接受的盐和溶剂合物。这些化合物可能对治疗和/或预防中枢神经系统疾病有用。
  • [EN] INDOLEAMINE DERIVATIVES FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES<br/>[FR] DÉRIVÉS INDOLÉAMINE UTILISÉS DANS LE TRAITEMENT DE MALADIES DU SYSTÈME NERVEUX CENTRAL
    申请人:ADAMED SP ZOO
    公开号:WO2013001499A1
    公开(公告)日:2013-01-03
    Indoleamine derivatives of formula (IA), wherein R1 represents benzyl unsubstituted or substituted with halogen atom, -OH, or C1-C3-alkyl; phenylsulphonyl unsubstituted or substituted in the phenyl ring with halogen atom, -OH or C1-C3-alkyl; G1 represents phenoxyalkyl, heteroaryloxyalkyl- or heterocyclyloxyalkyl-piperazine moiety; and pharmaceutically acceptable salts and solvates thereof. The compounds may be useful for the treatment and/or prevention of the central nervous system disorders.
    公式(IA)的吲哚胺衍生物,其中R1表示苯甲基未取代或取代有卤素原子,-OH或C1-C3-烷基;苯磺酰基未取代或在苯环中取代有卤素原子,-OH或C1-C3-烷基;G1表示苯氧基烷基,杂环氧基烷基-或杂环氧基烷基-哌嗪基;以及其药学上可接受的盐和溶解物。该化合物可用于治疗和/或预防中枢神经系统疾病。
  • [EN] PROCESS FOR SYNTHESIS AND CRYSTALLINE FORM OF 4-{3-[CIS-HEXAHYDROCYCLOPENTA[C]PYRROL-2(1H)-YL]PROPOXY}BENZAMIDE HYDROCHLORIDE, IN ADDITION TO THE ASSOCIATED FREE BASE AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAME<br/>[FR] PROCEDE DE SYNTHESE ET FORME CRISTALLINE DU CHLORHYDRATE DE 4-{3-[CIS-HEXAHYDROCYCLOPENTA[C]PYRROL-2(1H)-YL]PROPOXY} BENZAMIDE AINSI QUE LA BASE LIBRE ASSOCIEE ET LES COMPOSITIONS PHARMACEUTIQUES QUI LA CONTIENNENT
    申请人:SERVIER LAB
    公开号:WO2012168657A1
    公开(公告)日:2012-12-13
    Procédé de synthèse industriel et forme cristalline I du composé de formule (I), ainsi que la forme cristalline I de la base libre associée. Médicaments.
  • Effects of chronic mild stress on rats selectively bred for behavior related to bipolar disorder and depression
    作者:Ryan Murray、Katherine A. Boss-Williams、Jay M. Weiss
    DOI:10.1016/j.physbeh.2013.05.042
    日期:2013.7
    To test the possibility that chronic mild stress (CMS) might be unreliable in producing its often-intended outcome (i.e., decreased preference for sucrose, hypothesized to represent depression-relevant anhedonia) because it is typically applied to "normal" rats, a CMS procedure was applied to rats that may possess genetic susceptibility to affective disorders, having had been selectively-bred to show behavior indicative of such disorders. These rat lines were: Hyperactive (HYPER) rats, which show characteristics of bipolar disorder, Swim-test Susceptible (SUS) and Swim-test Resistant (RES) rats, being susceptible or resistant to effects of stress in the swim test, Swim High-active (SwHi) and Swim Low-active (SwLo) rats, which innately show high or low activity in the swim test These selectively-bred lines were compared to normal, non-selectively bred (NS) rats. During CMS, HYPER rats, both females and males, as well as RES and SwHi rats, showed reduced consumption of a palatable 2% sucrose solution, and reduced preference for sucrose (vs. water) in comparison to non-stressed rats (no CMS) of the same lines. In contrast, CMS produced no decrease in sucrose consumption or in preference for sucrose in normal NS rats, and actually a caused a slight increase in sucrose consumption and preference in male NS rats. Other measures that indicate depression - food intake and motor activity in the home cage - were also assessed. SwLo and SwHi showed greater sensitivity to having their home-cage ambulatory activity reduced by CMS than did NS rats, but no other such differences relative to NS rats were seen for these other measures; thus, changes in sucrose intake or preference could not be explained by a change in caloric intake. These results suggest that the genetic attributes of animals can influence the outcome of CMS, and that the application of CMS to normal, non-selected rats may account, at least in part, for the unreliability of CMS in decreasing consumption of palatable substances and decreasing preference for such substances. (C) 2013 Published by Elsevier Inc.
  • Synthesis, computational studies, and preliminary pharmacological evaluation of new arylpiperazines as potential antipsychotics
    作者:Sushil Kumar、A. K. Wahi、Ranjit Singh
    DOI:10.1007/s00044-011-9630-4
    日期:2012.7
    A series of long-chain arylpiperazines bearing a salicylamide fragment were synthesized, and the target compounds were evaluated for atypical antipsychotic activity in apomorphine-induced climbing behavior (D-2 antagonism) and 5-HTP-induced head twitches (5-HT2A antagonism) along with catalepsy studies in mice. The physicochemical similarity values of the target compounds with respect to standard drugs, clozapine, ketanserin, and risperidone, were determined using software programs. The test compounds demonstrated good similarity values with respect to the standard drugs. The compounds 3a (4) showed maximum atypical antipsychotic like profile.
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