78441-62-0 (尼扎替丁中间体,2-(Dimethylaminomethyl)-4-(2-aminoethylthiomethyl)thiazole)

CAS号:
78441-62-0
中文名称:
尼扎替丁中间体
英文名称:
2-(Dimethylaminomethyl)-4-(2-aminoethylthiomethyl)thiazole
分子式:
C9H17N3S2
分子量:
231.381378889084

尼扎替丁中间体(78441-62-0)名称与标识符

名称

中文别名:
2-(二甲氨基甲基)-4-(2-氨乙基硫甲基)噻唑;2-二甲基氨基甲基-4-(2-氨基乙基硫代甲基)噻唑;尼扎替丁中间体;
英文别名:
2-(((2-((Dimethylamino)methyl)thiazol-4-yl)methyl)thio)ethanamine;2-(Dimethylaminomethyl)-4-(2-aminoethylthiomethyl)thiazole;2-(Dimethylaminomethyl)-4-(2-aminoethylthiomethyl)-thiazole;2-[[2-[(dimethylamino)methyl]-1,3-thiazol-4-yl]methylsulfanyl]ethanamine;2-Thiazolemethanamine,4-[[(2-aminoethyl)thio]methyl]-N,N-dimethyl-;CEP-18770;2-[[2-(Dimethylaminomethyl)-1,3-Thiazol-4-Yl]Methylsulfanyl]Ethanamine;2-{[2-(dimethylamino)methyl-4-thiazolyl]methylthio}ethylamine;4-(2-Aminoethyl)thiomethyl-2-dimethylaminomethylthiazole;4-[[(2-aminoethyl)thio]-methyl]-N,N-dimethyl-2-thiazolemethanamine;4-<(2-Aminoethyl)-thiomethyl>-2-dimethylaminomethyl-thiazol;EINECS 278-909-9;AK115616;2-Thiazolemethanamine, 4-[[(2-aminoethyl)thio]methyl]-N,N-dimethyl-;4-[[(2-aminoethyl)thio]methyl]-N,N-dimethyl-2-thiazolemethanamine;2-[2-dimethylaminomethyl-4-thiazolylmethylthio]ethylamine;2-(2-Dimethylaminomethyl-4-thiazolylmethylthio)ethylamine;2-Thia;DTXSID00999768;A839421;FT-0653456;C9H17N3S2;2-Thiazolemethanamine, 4-(((2-aminoethyl)thio)methyl)-N,N-dimethyl-;2-[[2-[(dimethylamino)methyl]thiazol-4-yl]methylsulfanyl]ethanamine;2-(Dimethylaminomethyl)-4-(2-aminoethylthiomethyl)thiazole;NS00121265;78441-62-0;FLUORESCEINMONO-BETA-D-GALACTOPYRANOSIDE;AKOS015898888;MFCD08703310;FDMDNIIUCZHKFE-UHFFFAOYSA-N;CS-0151294;2-(((2-((DIMETHYLAMINO)METHYL)THIAZOL-4-YL)METHYL)SULFANYL)ETHANAMINE;2-[({2-[(Dimethylamino)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]ethan-1-amine;C76510;4-(((2-AMINOETHYL)THIO)METHYL)-N,N-DIMETHYL-2-THIAZOLEMETHANAMINE;2-[(2-dimethylaminomethyl-4-thiazolyl)methylthio]ethylamine;SCHEMBL4348396;W-104281;2-dimethylaminomethyl-4-(2-aminoethyl)thiomethylthiazole;2-[[[2-[(Dimethylamino)methyl]-4-thiazolyl]methyl]thio]ethanamine;SY107611;NIZATIDINE IMPURITY D [EP IMPURITY];2-(2-Dimethylaminomethyl-thiazol-4-ylmethylsulfanyl)-ethylamine;UNII-HHG5BM73J9;HHG5BM73J9;4-(((2-Aminoethyl)thio)methyl)-N,N-dimethylthiazole-2-methylamine;2-([2-(dimethylaminomethyl)-4-thiazolyl]methylthio)ethylamine;AS-14394;2-Thiazolemethanamine, 4-[[(2-aminoethyl)thio]methyl]-N,N-dimethyl-; 4-[[(2-Aminoethyl)thio]methyl]-N,N-dimethyl-2-thiazolemethanamine; 2-[[[2-[(Dimethylamino)methyl]thiazol-4-yl]methyl]sulphanyl]ethanamine; 2-(Dimethylaminomethyl)-4-(2-aminoethylthiomethyl)thiazole; Nizatidine Imp. D (EP); Nizatidine EP Impurity D;

标识符

MDL:
MFCD08703310
InChIKey:
FDMDNIIUCZHKFE-UHFFFAOYSA-N
Inchi:
1S/C9H17N3S2/c1-12(2)5-9-11-8(7-14-9)6-13-4-3-10/h7H,3-6,10H2,1-2H3
SMILES:
S1C=C(CSCCN)N=C1CN(C)C

尼扎替丁中间体(78441-62-0)物化性质

实验特性

  • LogP : 2.09690
  • PSA : 95.69000
  • 沸点 : 338.9±37.0 °C at 760 mmHg
  • 熔点 : NA
  • 蒸气压 : 0.0±0.7 mmHg at 25°C
  • 闪点 : 158.8±26.5 °C
  • 密度 : 1.2±0.1 g/cm3

计算特性

  • 精确分子量 : 231.08600
  • 氢键供体数量 : 1
  • 氢键受体数量 : 5
  • 可旋转化学键数量 : 6
  • 同位素质量 : 231.08638990g/mol
  • 重原子数量 : 14
  • 复杂度 : 155
  • 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 : 1
  • 疏水参数计算参考值(XlogP) : 0.4
  • 拓扑分子极性表面积 : 95.7

尼扎替丁中间体(78441-62-0)国际标准相关数据

EINECS:
278-909-9

尼扎替丁中间体(78441-62-0)海关数据

海关编码:
2934100090
海关数据:

中国海关编码:

2934100090

概述:

2934100090. 结构上含有一个非稠合噻唑环的化合物(不论是否氢化). 增值税率:17.0%. 退税率:9.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素:

品名, 成分含量, 用途

Summary:

2934100090 other compounds containing an unfused thiazole ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

尼扎替丁中间体(78441-62-0)推荐厂家 更多厂家(29)

尼扎替丁中间体(78441-62-0)参考资料

Reaxys RN:
PubChem CID: