(7R,8R,9R)-10-acetyl-7-hydroxy-2methyl-9-phenyl-8-pivaloyloxy-7,8,9,10-tetrahydroimidazo[1,2-h][1,7]naphthyridine
基本情報
- 標準SMILES
CC(=O)N1c2c(ccn3cc(C)nc23)[C@@H](O)[C@H](OC(=O)C(C)(C)C)[C@H]1c1ccccc1- InChIKey
UHBMBEKYSKCUKV-HMXCVIKNSA-N- 分子式
- C24H27N3O4
- 平均分子量
- 421.5 g/mol
- 単同位体質量
- 421.20015635
名称と識別子
- 優先名称
- (7R,8R,9R)-10-acetyl-7-hydroxy-2methyl-9-phenyl-8-pivaloyloxy-7,8,9,10-tetrahydroimidazo[1,2-h][1,7]naphthyridine
- IUPAC
- [(7R,8R,9R)-10-acetyl-7-hydroxy-2-methyl-9-phenyl-8,9-dihydro-7H-imidazo[1,2-h][1,7]naphthyridin-8-yl] 2,2-dimethylpropanoate
名称と別名
SCHEMBL5841393UHBMBEKYSKCUKV-HMXCVIKNSA-N(7R,8R,9R)-10-Acetyl-7-hydroxy-2-methyl-8-pivaloyloxy-9-phenyl-7.8.9.10-tetrahydro-imidazo[1.2-h][1.7]naphthyridine(7r,8r,9r)-10-acetyl-7-hydroxy-2-methyl-9-phenyl-8-pivaloyloxy-7,8,9,10-tetrahydroimidazo[1,2-h][1,7]naphthyridine(7R,8R,9R)-10-acetyl-7-hydroxy-2-methyl-9-phenyl-8-pivaloyloxy-7.8.9.10-tetrahydro-imidazo[1.2-h][1.7]naphthyridine(7R,8R,9R)-10-acetyl-7-hydroxy-2-methyl-9-phenyl-8-pivaloyloxy-7.8.9.10-tetrahydroimidazo[1.2-h][1.7]naphthyridine(7R,8R,9R)-10-acetyl-7-hydroxy-2methyl-9-phenyl-8-pivaloyloxy-7,8,9,10-tetrahydroimidazo[1,2-h][1,7]naphthyridine
データベース識別子
- PubChem CID
- 69586755
物性
構造計算による物性
- XLogP
- 3.3
- 極性表面積
- 84.1 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 5
- 回転可能結合数
- 4
- 重原子数
- 31
- 形式電荷
- 0
- 複雑度
- 687
関連反応
2 件
化合物ノート
読み込み中…