3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate
概要:3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate(CAS 74051-34-6)是一种化学化合物,分子式为C26H42BrNO3,分子量为495.23 g/mol。河南科弘生物科技有限公司提供CRO/CDMO定制合成服务,支持克级到吨级规格。
(8-methyl-8-octyl-8-azoniabicyclo[3.2.1]octan-3-yl) 4-hydroxy-2-phenylbutanoate bromide
又称:3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate, 1-alpha-H,5-alpha-H-Tropanium, 3-hydroxy-8-octyl-, bromide, 4-hydroxy-2-phenylbutanoate, (8-methyl-8-octyl-8-azoniabicyclo[3.2.1]octan-3-yl) 4-hydroxy-2-phenylbutanoate bromide, (8-methyl-8-octyl-8-azoniabicyclo[3.2.1]octan-3-yl) 4-hydroxy-2-phenylbutanoate,bromide, 3-[(4-Hydroxy-2-phenylbutanoyl)oxy]-8-methyl-8-octyl-8-azabicyclo[3.2.1]octan-8-ium bromide
| 分子式 | C26H42BrNO3 |
|---|---|
| 分子量 | 495.23 g/mol |
| LogP | 2.2003 |
| 拓扑极性表面积 | 46.53 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 3 |
| 可旋转键数 | 12 |
| 精确质量 | 495.2348 |
| 重原子数 | 31 |
| 复杂度 | 639.31195 |
化学标识符
| CAS 编号 | 74051-34-6 |
|---|---|
| SMILES | CCCCCCCC[N+]1(C2CCC1CC(C2)OC(=O)C(CCO)C3=CC=CC=C3)C.[Br-] |
产品概述
3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate(CAS 74051-34-6),分子式为C26H42BrNO3,分子量为495.23 g/mol。IUPAC名:(8-methyl-8-octyl-8-azoniabicyclo[3.2.1]octan-3-yl) 4-hydroxy-2-phenylbutanoate bromide。
3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate化学性质概览
属性洞察:3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate
3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate的XLogP值为2.2003,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate的拓扑极性表面积(TPSA)为46.53 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate有1个氢键供体和3个氢键受体,均在类药范围内,提示具有较好的口服生物利用度潜力。
常见问题
常见问题
3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate的CAS号是多少?
3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate的CAS号为74051-34-6。
3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate的分子式是什么?
3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate的分子式为C26H42BrNO3。
3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate的分子量是多少?
3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate的分子量为495.23 g/mol。
在哪里可以购买3-Hydroxy-8-octyl-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate?
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