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盐酸贝那替嗪 | 57-37-4

盐酸贝那替嗪
Benactyzine hydrochloride
57-37-4
C20H26ClNO3
363.8783
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:盐酸贝那替嗪结构式
87563257
简介
Benactyzine hydrochloride 是一种丁酰胆碱酯酶 (BChE) 抑制剂,其 Ki 值为 0.010 mM。
名称和标识符
MDL MFCD00012624
InChIKey ZCEHOOLYWQBGQO-UHFFFAOYSA-N
Inchi 1S/C20H25NO3.ClH/c1-3-21(4-2)15-16-24-19(22)20(23,17-11-7-5-8-12-17)18-13-9-6-10-14-18;/h5-14,23H,3-4,15-16H2,1-2H3;1H
SMILES Cl[H].O(C(C(C1C([H])=C([H])C([H])=C([H])C=1[H])(C1C([H])=C([H])C([H])=C([H])C=1[H])O[H])=O)C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H]
别名信息
- 中文别名 -
  • 盐酸贝那替嗪
  • 盐酸苯乃嗪
  • 乙胺痉平
  • 2-二乙基氨基乙基 2-羟基-2,2-二苯乙酸酯盐酸盐
  • Benactyzine Hydrochloride 盐酸贝那替嗪
  • 盐酸贝那替秦
  • 2-(二乙基氨基)乙基二苯乙醇酸酯盐酸盐
  • 苯羟乙胺盐酸盐
  • 二苯乙醇酸-2-(二乙氨基)乙酯盐酸盐
  • 盐酸苯那辛
  • 胃复康
- 英文别名 -
  • benactyzine hydrochloride
  • Benactyzine HCL
  • 2-Diethylaminoethyl Diphenylglycolate Hydrochloride
  • 2-(diethylamino)ethyl 2-hydroxy-2,2-diphenylacetate,hydrochloride
  • BENACTYINE HYDROCHLORIDE
  • Benzilic Acid 2-(Diethylamino)ethyl Ester Hydrochloride
  • 2-(Diethylamino)ethyl Benzilate Hydrochloride
  • 2-Diethylaminoethyl 2-hydroxy-2,2-diphenylacetate hydrochloride
  • Neuroleptone
  • Tranquilline
  • Amitakon
  • Valladon
  • Ibiotyzil
  • Destendo
  • Benaktin
  • Valladan
  • Neurobenzil
  • Neuraktil
  • Nervatil
  • Nervacton
  • Leucidil
  • Suavitil
  • Prokalm
  • Procalm
  • Amysyl
  • Stoikon
  • Parpon
  • Katron
  • Cevanol
  • Phobex
  • Nutinal
  • Amyzyl
  • Amizil
  • Aktozin
  • Parazan
  • Parasan
  • Lucidil
  • Cafron
  • Arkadin
  • Amisyl
  • Amisil
  • Fobex
  • Cedad
  • Amizil hydrochloride
  • Benactyzine chloride
  • Amizyl hydrochloride
  • Morcain
  • Benactizine hydrochloride
  • Benactyzin [Czech]
  • 2-(diethylamino)ethyl 2-hydroxy-2,2-diphenylacetate hyd
  • 57-37-4
  • NC00319
  • EA 2092
  • Opera_ID_144
  • s3701
  • SCHEMBL4419579
  • 2-(Difenyl-hydroxyacetoxy)ethyl-diethylammoniumchlorid
  • WLN: QXR&R&VO2N2&2 &GH
  • Ethanol, 2-(diethylamino)-, benzilate hydrochloride
  • D88595
  • beta-Diethylaminoethyl benzilate hydrochloride
  • Benactyzine HCl
  • BENACTYZINE HYDROCHLORIDE [VANDF]
  • 2-(diethylamino)ethyl 2-hydroxy-2,2-diphenylacetate hydrochloride
  • Benzilic acid, 2-(diethylamino)ethyl ester hydrochloride
  • SMR000059142
  • MFCD00012624
  • MLS000069801
  • CHEMBL1584883
  • Diphenylglycollic acid 2-(diethylamino)ethyl ester hydrochloride
  • DS-11395
  • HY-B1542A
  • Ethanol, benzilate hydrochloride
  • NSC-16339
  • BENACTYZINE HYDROCHLORIDE [WHO-DD]
  • B0053
  • 2-(diethylamino)ethyl 2-hydroxy-2,2-diphenylacetate
  • hydrochloride
  • Benactyzine hydrochloride, >=98% (HPLC)
  • Benactyzine hydrochloride
  • NSC 16339
  • CS-8073
  • .beta.-Diethylaminoethyl benzilate hydrochloride
  • Benactizine
  • MLS001148661
  • AKOS015901413
  • 2-diethylaminoethyl 2-hydroxy-2,2-diphenylacetate hydrochloride
  • AY-5406-1
  • Benzeneacetic acid, .alpha.-hydroxy-.alpha.-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
  • Benzilic acid, 2-(diethylamino)ethyl ester, hydrochloride
  • CCG-101069
  • AI3-26379
  • Amioyl
  • UNII-26R628272Q
  • Q27254124
  • 2-Diethylaminoethylester kyseliny benzilove hydrochlorid
  • DTXSID8052774
  • 2-(Difenyl-hydroxyacetoxy)ethyl-diethylammoniumchlorid [Czech]
  • 2-(Diethylamino)ethyl benzilate hydrochloride
  • Benzilic acid beta-diethylaminoethyl ester hydrochloride
  • 57-37-4 (HCl)
  • FT-0612170
  • AY 5406-1
  • EINECS 200-324-4
  • 26R628272Q
  • BENACTYZINE HYDROCHLORIDE [MI]
  • 2-Diethylaminoethyl benzilate hydrochloride
  • AC-32563
  • AY-5406
  • LS-32471
  • Benzilate du diethylamino-ethanol chlorhydrate
  • Benzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride
  • 2-Diethylaminoethyl diphenylglycolate hydrochloride
  • Benzilic acid .beta.-diethylaminoethyl ester hydrochloride
  • Tranquillin
  • 2-Diethylaminoethylester kyseliny benzilove hydrochlorid [Czech]
  • Benzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
  • Win 5606
  • Benzeneacetic acid, .alpha.-hydroxy-.alpha.-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride
  • MLS001424153
  • NSC16339
  • Benzilate du diethylamino-ethanol chlorhydrate [French]
  • benactyzinhydrochlorid-
  • BENACTYZINE HYDROCHLORIDE [MART.]
  • Benactyzin
  • NS00078857
  • alpha-Hydroxy-alpha-phenylbenzeneacetic acid 2-(diethylamino)ethyl ester
  • SY057330
物化性质
实验特性
LogP 3.60950
PSA 49.77000
Merck 1029
沸点 409.3°Cat760mmHg
熔点 175.0 to 179.0 deg-C
闪点 201.4°C
颜色与性状 Powder
溶解性 25℃时100ml水中可溶解该品14.9g,几乎不溶于乙醚。
密度 1.115
计算特性
精确分子量 363.16000
氢键供体数量 2
氢键受体数量 4
可旋转化学键数量 9
同位素质量 363.16
重原子数量 25
复杂度 351
同位素原子数量 0
确定原子立构中心数量 0
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 2
疏水参数计算参考值(XlogP)
互变异构体数量
表面电荷 0
拓扑分子极性表面积 49.8
国际标准相关数据
EINECS 200-324-4
生产方法和用途
方法
由二苯乙醇酸与1-氯-2二乙氨基乙烷反应得到。将甲苯、二苯乙醇酸和1-氯-2-二乙氨基乙烷在反应锅内加热回流3h,冷却结晶,甩滤得到的粗品经精制即为该品。
用途
抗胆碱药。
生产方法 由二苯乙醇酸与1-氯-2二乙氨基乙烷反应得到。将甲苯、二苯乙醇酸和1-氯-2-二乙氨基乙烷在反应锅内加热回流3h,冷却结晶,甩滤得到的粗品经精制即为该品。
相关文献
专业数据库参考
PubChemId 87563257
参考资料
Reaxys RN 3920541
Beilstein MFCD00012624
化合物详情(旧版)

SMILES

Cl.CCN(CC)CCOC(=O)C(C1=CC=CC=C1)(O)C2=CC=CC=C2

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