4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one
概要:4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one(CAS 651029-09-3)是一种化学化合物,分子式为C18H18N2O2,分子量为294.14 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。
4-[4-[(dimethylamino)methyl]phenyl]-5-hydroxy-2H-isoquinolin-1-one
又称:kcl440, 4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one, 4-[4-[(dimethylamino)methyl]phenyl]-5-hydroxy-2H-isoquinolin-1-one, 1(2H)-Isoquinolinone, 4-[4-[(dimethylamino)methyl]phenyl]-5-hydroxy-, 1,2-Dihydro-4-[4-(dimethylaminomethyl)phenyl]-5-hydroxy-1-oxoisoquinoline
| 分子式 | C18H18N2O2 |
|---|---|
| 分子量 | 294.14 g/mol |
| LogP | 2.9623 |
| 拓扑极性表面积 | 56.33 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 3 |
| 可旋转键数 | 3 |
| 精确质量 | 294.13684 |
| 重原子数 | 22 |
| 复杂度 | 864.3847 |
化学标识符
| CAS 编号 | 651029-09-3 |
|---|---|
| SMILES | CN(C)CC1=CC=C(C=C1)C2=CNC(=O)C3=C2C(=CC=C3)O |
产品概述
4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one(CAS 651029-09-3),分子式为C18H18N2O2,分子量为294.14 g/mol。IUPAC名:4-[4-[(dimethylamino)methyl]phenyl]-5-hydroxy-2H-isoquinolin-1-one。
4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one化学性质概览
属性洞察:4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one
4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one的XLogP值为2.9623,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one的拓扑极性表面积(TPSA)为56.33 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one有2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
4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one的CAS号是多少?
4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one的CAS号为651029-09-3。
4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one的分子式是什么?
4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one的分子式为C18H18N2O2。
4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one的分子量是多少?
4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one的分子量为294.14 g/mol。
在哪里可以购买4-(4-((dimethylamino)methyl)phenyl)-5-hydroxyisoquinolin-1(2H)-one?
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