5H-1,3-Dioxolo[4,5-c]pyrrole-5-carboxylicacid,4-[4-(1,1-dimethylethoxy)-5-[(phenylmethoxy)methyl]-5H-pyrrolo[3,2-d]pyrimidin-7-yl]-6-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]tetrahydro-2,2-dimethyl-,1,1-dimethylethyl ester, (3aS,4S,6R,6aR)-
- 中文别名:5-噻唑甲酰胺,2-氯-
- 中文释义:5-噻唑甲酰胺,2-氯-
- 英文别名:5H-1,3-Dioxolo[4,5-c]pyrrole-5-carboxylicacid,4-[4-(1,1-dimethylethoxy)-5-[(phenylmethoxy)methyl]-5H-pyrrolo[3,2-d]pyrimidin-7-yl]-6-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]tetrahydro-2,2-dimethyl-,1,1-dimethylethylester,(3aS,4S,6R,6aR)-;
5H-1,3-Dioxolo4,5-cpyrrole-5-carboxylic acid, 4-4-(1,1-dimethylethoxy)-5-(phenylmethoxy)methyl-5H-pyrrolo3,2-dpyrimidin-7-yl-6-(1,1-dimethylethyl)dimethylsilyloxymethyltetrahydro-2,2-dimethyl-, 1,1-dimethylethyl ester, (3aS,4S,6R,6aR)-
- CAS No.:299917-26-3
- 分子式:C37H56N4O7Si
- 分子量:0
- InChI:The Key: XYRGFXHWJOPSIW-DNXYURMGSA-N
- 分子结构式:
分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值(XlogP):3.4
2.氢键供体数量:1
3.氢键受体数量:6
4.可旋转化学键数量:4
5.互变异构体数量:无
6.拓扑分子极性表面积:66.4
7.重原子数量:26
8.表面电荷:0
9.复杂度:487
10.同位素原子数量:0
11.确定原子立构中心数量:3
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