uspto-grants-2014_12 · 10.6084/m9.figshare.5104873.v1 · US08916709B2
查看![(9H-fluoren-9-yl)methyl 4-(5-((2S,5R)-6-(benzyloxy)-7-oxo-1,6-diaza-bicyclo[3.2.1]octan-2-yl)-1,2,4-oxadiazol-3-yl)piperidine-1-carboxylate 分子结构式](/api/mol/86700694/svg/360x280.svg)
HCID86700694
(9H-fluoren-9-yl)methyl 4-(5-((2S,5R)-6-(benzyloxy)-7-oxo-1,6-diaza-bicyclo[3.2.1]octan-2-yl)-1,2,4-oxadiazol-3-yl)piperidine-1-carboxylate
9H-fluoren-9-ylmethyl 4-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,2,4-oxadiazol-3-yl]piperidine-1-carboxylate
C35H35N5O5605.7 g/mol
IDENTITY
结构与身份
- 标准SMILES
- O=C(OCC1c2ccccc2-c2ccccc21)N1CCC(c2noc([C@@H]3CC[C@@H]4CN3C(=O)N4OCc3ccccc3)n2)CC1
- InChIKey
- WBEMNWXEXCVRLV-NJHZRGNWSA-N
- 分子式
- C35H35N5O5
- 平均分子量
- 605.7 g/mol
- 单同位素质量
- 605.26381923
COMPUTED
结构计算性质
- XLogP
- 5
- 极性表面积
- 101 Ų
- 氢键供体
- 0
- 氢键受体
- 7
- 可旋转键
- 8
- 重原子
- 45
- 形式电荷
- 0
- 复杂度
- 1,030
ALIASES
名称与别名
SCHEMBL15347402WBEMNWXEXCVRLV-NJHZRGNWSA-N(9H-fluoren-9-yl)methyl 4-(5-((2S,5R)-6-(benzyloxy)-7-oxo-1,6-diaza-bicyclo[3.2.1]octan-2-yl)-1,2,4-oxadiazol-3-yl)piperidine-1-carboxylate
REACTIONS
参与反应
uspto-grants-2014_12 · 10.6084/m9.figshare.5104873.v1 · US08916709B2
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