HCID69669489

(1S,2S)-1-acetamido-N-tert-butyl-2-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propyl)cyclopentanecarboxamide

trans-(1S,2S)-1-acetamido-N-tert-butyl-2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propyl]cyclopentane-1-carboxamide

C21H39BN2O4394.4 g/mol

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IDENTITY

结构与身份

标准SMILES: CC(=O)N[C@@]1(C(=O)NC(C)(C)C)CCC[C@@H]1CCCB1OC(C)(C)C(C)(C)O1
InChIKey: OUMNKVZBLGJKHW-IERDGZPVSA-N
分子式: C21H39BN2O4
平均分子量: 394.4 g/mol
单同位素质量: 394.3002879

COMPUTED

结构计算性质

已同步

极性表面积: 76.7 Å²
氢键供体: 2
氢键受体: 4
可旋转键: 7
重原子: 28
形式电荷: 0
复杂度: 584

ALIASES

名称与别名

共 4 条

SCHEMBL6113756OUMNKVZBLGJKHW-IERDGZPVSA-N(1S,2S)-1-acetamido-N-tert-butyl-2-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propyl) cyclopentanecarboxamide(1S,2S)-1-acetamido-N-tert-butyl-2-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propyl)cyclopentanecarboxamide

REACTIONS

参与反应

2 条

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09440995B2

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uspto-grants-2016_01 · 10.6084/m9.figshare.5104873.v1 · US09233985B2

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