4'-[(1-{[5-({[Tert-butyl(dimethyl)silyl]oxy}methyl)pyridin-2-yl]methyl}-2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl)methyl]biphenyl-2-carbonitrile
基本情報
- 標準SMILES
CCCc1nc(C)n(Cc2ccc(CO[Si](C)(C)C(C)(C)C)cn2)c(=O)c1Cc1ccc(-c2ccccc2C#N)cc1- InChIKey
QCULVFCIPGEFII-UHFFFAOYSA-N- 分子式
- C35H42N4O2Si
- 平均分子量
- 578.8 g/mol
名称と識別子
- 優先名称
- 4'-[(1-{[5-({[Tert-butyl(dimethyl)silyl]oxy}methyl)pyridin-2-yl]methyl}-2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl)methyl]biphenyl-2-carbonitrile
- IUPAC
- 2-[4-[[1-[[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]methyl]-2-methyl-6-oxo-4-propylpyrimidin-5-yl]methyl]phenyl]benzonitrile
名称と別名
SCHEMBL1894790QCULVFCIPGEFII-UHFFFAOYSA-N4'-[(1-{[5-({[tert-butyl(dimethyl)silyl]oxy}methyl)pyridin-2-yl]methyl}-2-methyl-6-oxo-4-propyl-1, 6-dihydropyrimidin-5-yl)methyl]biphenyl-2-carbonitrile4'-[(1-{[5-({[tert-butyl(dimethyl)silyl]oxy}methyl)pyridin-2-yl]methyl}-2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl)methyl]biphenyl-2-carbonitrile
データベース識別子
- PubChem CID
- 57460760
物性
構造計算による物性
- 極性表面積
- 78.6 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 5
- 回転可能結合数
- 11
- 重原子数
- 42
- 形式電荷
- 0
- 複雑度
- 1,040
関連反応
5 件
化合物ノート
読み込み中…