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91-75-8生产厂家

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91-75-8

91-75-8结构式
91-75-8结构式
  • 常用中文名:安他唑啉
  • 常用英文名:Antazoline
  • CAS号:91-75-8
  • 分子式:C17H19N3
  • 分子量:265.353
  • 相关类别: 医药中间体 杂环化合物 噻吩类化合物
  • 发布时间:2018-05-12 08:00:00
  • 更新时间:2024-01-09 17:05:30
  • 安替唑林是一种影响中枢神经系统活动的H1受体拮抗剂,具有强大的抗心律失常作用[1][2][3]。

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中文名 安他唑啉
英文名 antazoline
中文别名 N-苄基-N-(4,5-二氢-1H-咪唑-2-基甲基)苯胺
盐酸安太林
英文别名 Phenazoline
1H-Imidazole-2-methanamine, 4,5-dihydro-N-phenyl-N-(phenylmethyl)-
Antistin
Histostab
Fenazolina
Phenazolin
Histazine
N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)phenylamine
EINECS 202-094-0
Antastan
Antistine
Antazoline
Imidamine
Antihistal
N-Benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline
N-Benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-anilin
MFCD00047013
Antasten
benzyl-(4,5-dihydro-1H-imidazol-2-ylmethyl)-phenyl-amine
N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-aniline
N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-N-(phenylmethyl)aniline
描述 安替唑林是一种影响中枢神经系统活动的H1受体拮抗剂,具有强大的抗心律失常作用[1][2][3]。
相关类别
靶点

H1 receptor

体外研究 安替唑林对HepAD38和Huh7细胞上清液中的HBV DNA有良好的抑制作用,EC50值分别为2.910μmol/L和2.349μmol/L[2]。细胞毒性试验[2]细胞系:HepAD38细胞浓度:10μmol/L孵育时间:5天结果:浓度为10μmol/L时,没有表现出明显的细胞毒性,并且对上清液中的HBV DNA具有剂量依赖性抑制作用。RT-PCR[2]细胞系:Huh7细胞浓度:30μmol/L、10μmol/L、3.33μmol/1、1.1μmol/L0.370μmol/l0.123μmol/升孵育时间:4天结果:对上清液中的HBV DNA有明显的抑制作用,呈剂量依赖性。
体内研究 作为H1受体拮抗剂的安他唑啉(IP;0.01 ml/g;30min)可降低卡马西平和二苯海因的抗惊厥活性[3]。动物模型:瑞士小鼠[3]剂量:0.01 mL/g给药:安替唑林(IP;0.01 mL/g;30min)结果:显示出一定的促惊厥活性。
参考文献

[1]. Maciej T Wybraniec, et al. Efficacy and safety of antazoline for cardioversion of atrial fibrillation: propensity score matching analysis of a multicenter registry (CANT II Study). Pol Arch Intern Med. 2022 Jun 29;132(6):16234.

[2]. Jing Li, et al. Repurposing of Antazoline Hydrochloride as an Inhibitor of Hepatitis B Virus DNA Secretion. Virol Sin. 2021 Jun;36(3):501-509.

[3]. MariuszŚwiąder,et al. Influence of antazoline and ketotifen on the anticonvulsant activity of conventional antiepileptics against maximal electroshock in mice. Eur Neuropsychopharmacol. 2004 Aug;14(4):307-18.

密度 1.1±0.1 g/cm3
沸点 475.5±38.0 °C at 760 mmHg
熔点 159ºC
分子式 C17H19N3
分子量 265.353
闪点 241.4±26.8 °C
精确质量 265.157898
PSA 27.63000
LogP 4.39
外观性状 晶体,无气味的
蒸汽压 0.0±1.2 mmHg at 25°C
折射率 1.608
储存条件 -20°C
分子结构

1、 摩尔折射率:83.31

2、 摩尔体积(cm3/mol):240.9

3、 等张比容(90.2K):619.9

4、 表面张力(dyne/cm):43.8

5、 极化率(10-24cm3):33.02

计算化学

1.疏水参数计算参考值(XlogP):2.6

2.氢键供体数量:1

3.氢键受体数量:2

4.可旋转化学键数量:5

5.互变异构体数量:无

6.拓扑分子极性表面积27.6

7.重原子数量:20

8.表面电荷:0

9.复杂度:314

10.同位素原子数量:0

11.确定原子立构中心数量:0

12.不确定原子立构中心数量:0

13.确定化学键立构中心数量:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:1

更多

1.性状:晶体。

2.熔点(℃):120-122。

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NJ2000000
CHEMICAL NAME :
2-Imidazoline, 2-((N-benzylanilino)methyl)-
CAS REGISTRY NUMBER :
91-75-8
BEILSTEIN REFERENCE NO. :
0233924
LAST UPDATED :
199612
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C17-H19-N3
MOLECULAR WEIGHT :
265.39
WISWESSER LINE NOTATION :
T5M CN BUTJ B1N1R&R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
OPHTAD Ophtalmologica. (S. Karger Pub., Inc., 79 Fifth Ave., New York, NY 10003) V.96- 1978- Volume(issue)/page/year: 143,154,1962 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
398 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 7,237,1957
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AEPPAE Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. (Berlin, Ger.) V.110-253, 1925-66. For publisher information, see NSAPCC. Volume(issue)/page/year: 237,171,1959
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
135 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 17,214,1967
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
61 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 188,189,1970 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M3378 No. of Facilities: 3 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 5 (estimated)

危害码 (欧洲) Xi
安全声明 (欧洲) S22-S24/25

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文献:Dash; Kudav; Parihar Journal of Heterocyclic Chemistry, 2006 , vol. 43, # 2 p. 401 - 404

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