uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08822430B2
查看HCID66620632
(2-methyl-1-{2-[5-(4-piperazin-1-yl-phenyl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-yl]-pyrrolidine-1-carbonyl}-propyl)-carbamic acid methyl ester
methyl N-[3-methyl-1-oxo-1-[2-[5-(4-piperazin-1-ylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]pyrrolidin-1-yl]butan-2-yl]carbamate
C30H48N6O4Si584.8 g/mol
IDENTITY
结构与身份
- 标准SMILES
- COC(=O)NC(C(=O)N1CCCC1c1ncc(-c2ccc(N3CCNCC3)cc2)n1COCC[Si](C)(C)C)C(C)C
- InChIKey
- QTXJREPOWJQYGQ-UHFFFAOYSA-N
- 分子式
- C30H48N6O4Si
- 平均分子量
- 584.8 g/mol
- 单同位素质量
- 584.35063057
COMPUTED
结构计算性质
- 极性表面积
- 101 Ų
- 氢键供体
- 2
- 氢键受体
- 7
- 可旋转键
- 12
- 重原子
- 41
- 形式电荷
- 0
- 复杂度
- 843
ALIASES
名称与别名
SCHEMBL204474QTXJREPOWJQYGQ-UHFFFAOYSA-N(2-Methyl-1-{2-[5-(4-piperazin-1-yl -phenyl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-yl]-pyrrolidine-1-carbonyl}-propyl)-carbamic acid methyl ester(2-Methyl-1-{2-[5-(4-piperazin-1-yl-phenyl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-yl]-pyrro lidine-1-carbonyl}-propyl)-carbamic acid methyl ester(2-methyl-1-{2-[5-(4-piperazin-1-yl-phenyl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-yl]-pyrrolidine-1-carbonyl}-propyl)-carbamic acid methyl ester
REACTIONS
参与反应
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