rac-3-[4,5-diphenyl-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-yl]-N-[2-((1R,2R,4R*)-2-hydroxy-5-phenyl-bicyclo[2.2.2]oct-5-en-2-yl)-ethyl]-N-methyl-propionamide

HCID 68414528

基本情報

標準SMILES: CN(CC[C@]1(O)C[C@H]2CC[C@@H]1C=C2c1ccccc1)C(=O)CCc1nc(-c2ccccc2)c(-c2ccccc2)n1COCC[Si](C)(C)C
InChIKey: WOYCDAIWVWUTLF-DNYGIMPFSA-N
分子式: C41H51N3O3Si
平均分子量: 661.9 g/mol

名称と識別子

優先名称: rac-3-[4,5-diphenyl-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-yl]-N-[2-((1R*,2R*,4R*)-2-hydroxy-5-phenyl-bicyclo[2.2.2]oct-5-en-2-yl)-ethyl]-N-methyl-propionamide
IUPAC: 3-[4,5-diphenyl-1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]-N-[2-[(1R,2R,4R)-2-hydroxy-5-phenyl-2-bicyclo[2.2.2]oct-5-enyl]ethyl]-N-methylpropanamide

名称と別名

SCHEMBL2846854WOYCDAIWVWUTLF-DNYGIMPFSA-Nrac-3-[4,5-diphenyl-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-yl]-N-[2-((1R*,2R*,4R*)-2-hydroxy-5-phenyl-bicyclo[2.2.2]oct-5-en-2-yl)-ethyl]-N-methyl-propionamide

データベース識別子

PubChem CID: 68414528

物性

構造計算による物性

極性表面積: 67.6 Å²
水素結合供与体数: 1
水素結合受容体数: 4
回転可能結合数: 14
重原子数: 48
形式電荷: 0
複雑度: 1,060