144371-00-6 ((4-amino-5-fluoro-1-2-(hydroxymethyl)-1,3-oxathiolan-5-yl-1,2-dihydropyrimidin-2-one)

CAS号:
144371-00-6
英文名称:
4-amino-5-fluoro-1-2-(hydroxymethyl)-1,3-oxathiolan-5-yl-1,2-dihydropyrimidin-2-one
分子式:
C8H10FN3O3S
分子量:
247.246703624725

4-amino-5-fluoro-1-2-(hydroxymethyl)-1,3-oxathiolan-5-yl-1,2-dihydropyrimidin-2-one(144371-00-6)名称与标识符

名称

英文别名:
Racivir;4-Amino-5-fluoro-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-1,2-dihydropyrimidin-2-one;4-amino-5-fluoro-1-(2-(hydroxymethyl)-1,3-oxathiolan-5-yl)pyrimidin-2(1H)-one;4-amino-5-fluoro-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2(1H)-one;XQSPYNMVSIKCOC-UHFFFAOYSA-N;Emtricitabine, (+/-)-;4-Amino-5-fluoro-1-((2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl)pyrimidin-2(1H)-one;HMS3655G21;BCP02951;STL445692;AK;4-amino-5-fluoro-1-2-(hydroxymethyl)-1,3-oxathiolan-5-yl-1,2-dihydropyrimidin-2-one;

标识符

MDL:
MFCD09954600
InChIKey:
XQSPYNMVSIKCOC-UHFFFAOYSA-N
Inchi:
1S/C8H10FN3O3S/c9-4-1-12(8(14)11-7(4)10)5-3-16-6(2-13)15-5/h1,5-6,13H,2-3H2,(H2,10,11,14)
SMILES:
S1C(CO)OC(C1)N1C(N=C(C(=C1)F)N)=O

4-amino-5-fluoro-1-2-(hydroxymethyl)-1,3-oxathiolan-5-yl-1,2-dihydropyrimidin-2-one(144371-00-6)物化性质

计算特性

  • 氢键供体数量 : 2
  • 氢键受体数量 : 5
  • 可旋转化学键数量 : 2
  • 重原子数量 : 16
  • 复杂度 : 374
  • 疏水参数计算参考值(XlogP) : -0.6
  • 拓扑分子极性表面积 : 113

4-amino-5-fluoro-1-2-(hydroxymethyl)-1,3-oxathiolan-5-yl-1,2-dihydropyrimidin-2-one(144371-00-6)推荐厂家 更多厂家(1)

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上海瀚思化工有限公司 18939883912
021-34536277
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