Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- C[Si](C)(C)C#Cc1cnn2c(C(F)(F)F)cc(-c3ccc(C(F)(F)F)cc3)nc12
- InChIKey
- DBEJRSPHFWZHKH-UHFFFAOYSA-N
- 分子式
- C19H15F6N3Si
- 平均分子量
- 427.4 g/mol
- 单同位素质量
- 427.093943
COMPUTED
结构计算性质
- 极性表面积
- 30.2 Ų
- 氢键供体
- 0
- 氢键受体
- 8
- 可旋转键
- 3
- 重原子
- 29
- 形式电荷
- 0
- 复杂度
- 651
物化、安全与法规信息正在同步。
ALIASES
名称与别名
7-Trifluoromethyl-5-(4-trifluoromethyl-phenyl)-3-trimethylsilanylethynyl-pyrazolo[1,5-a]pyrimidineSCHEMBL13474257-Trifluoromethyl-5-(4-trifluoromethyl-phenyl)-3-trimethylsilanylethynyl-pyrazolo[1,5-a]-pyrimidine
REACTIONS
相关反应
Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
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