5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde structure

5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde

概要:5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde(CAS 370584-62-6)是一种化学化合物,分子式为C22H20ClNO5,分子量为413.10 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。

5-chloro-2-[3-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-ynoxy]benzaldehyde

又称:5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde, 5-chloro-2-[3-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-ynoxy]benzaldehyde, 5-chloro-2-{[3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl]oxy}benzaldehyde

CAS: 370584-62-6
分子式 C22H20ClNO5
分子量 413.10 g/mol
LogP 3.5012
拓扑极性表面积 57.23 Ų
氢键供体数 0
氢键受体数 6
可旋转键数 4
精确质量 413.103
重原子数 29
复杂度 1010.4829

化学标识符

CAS 编号 370584-62-6
SMILES CN1CCC2=CC3=C(C(=C2C1C#CCOC4=C(C=C(C=C4)Cl)C=O)OC)OCO3

产品概述

5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde(CAS 370584-62-6),分子式为C22H20ClNO5,分子量为413.10 g/mol。IUPAC名:5-chloro-2-[3-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-ynoxy]benzaldehyde

🧪
安全数据表(MSDS / SDS) 在PubChem上查看实验室化学品安全摘要(LCSS)——包含GHS分类、危险说明、急救措施和操作注意事项。
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5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde化学性质概览

XLogP(分配系数)
3.5012
TPSA(拓扑极性表面积)
57.23
氢键供体数
0
氢键受体数
6
可旋转键数
4
重原子数
29
复杂度
1010.4829
精确质量
413.103
单同位素质量
413.103
数据来源: 化学性质数据引用自 PubChem,由美国国家医学图书馆(NLM)下属的国家生物技术信息中心(NCBI)维护的全球最大开放化学数据库。

属性洞察:5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde

5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde的XLogP值为3.5012,表明该化合物具有亲脂性(脂溶性好),可能影响其吸收、分布和配方策略。 5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde的拓扑极性表面积(TPSA)为57.23 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde有0个氢键供体和6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

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常见问题

5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde的CAS号是多少?

5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde的CAS号为370584-62-6。

5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde的分子式是什么?

5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde的分子式为C22H20ClNO5。

5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde的分子量是多少?

5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde的分子量为413.10 g/mol。

在哪里可以购买5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde?

您可以直接向科弘生物询价5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。

科弘生物是否提供5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde的定制合成服务?

是的,科弘生物提供5-chloro-2-((3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)prop-2-yn-1-yl)oxy)benzaldehyde及相关化合物的定制合成服务。请联系我们并告知您的具体需求,包括数量、纯度和交期。

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