HCID5460339

Bunolol, (R)-

5-[(2R)-3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-naphthalen-1-one

C17H25NO3291.4 g/molCAS 47141-41-3

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IDENTITY

结构与身份

标准SMILES: CC(C)(C)NC[C@@H](O)COc1cccc2c1CCCC2=O
InChIKey: IXHBTMCLRNMKHZ-GFCCVEGCSA-N
分子式: C17H25NO3
平均分子量: 291.4 g/mol
单同位素质量: 291.18344366

COMPUTED

结构计算性质

已同步

XLogP: 2.4
极性表面积: 58.6 Å²
氢键供体: 2
氢键受体: 4
可旋转键: 6
重原子: 21
形式电荷: 0
复杂度: 350

PROPERTIES

实验与物化性质

Kovats Retention Index

2352

ALIASES

名称与别名

共 29 条

Bunolol, (R)-D-BunololW8BFD3J6YX47141-41-31(2H)-Naphthalenone, 5-((2R)-3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)-3,4-dihydro-1(2H)-Naphthalenone, 5-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)-3,4-dihydro-, (R)-RefChem:199991UNII-W8BFD3J6YX5-[(2R)-3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-naphthalen-1-onelevobunolol-(+)(R)-BunololDEXTROBUNOLOLlevobunolol-(+/-)Prestwick0_000857Prestwick1_000857Prestwick2_000857Prestwick3_000857Levobunolol RC 4 (Base)BSPBio_000873BUNOLOL, (+)-

REACTIONS