2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione structure

2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione

概要:2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione(CAS 774561-57-8)是一种化学化合物,分子式为C31H37NO6,分子量为519.26 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。

2-[3-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-6-methoxy-9,11,11-trimethyl-2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraen-3-yl]-5,5-dimethylcyclohexane-1,3-dione

又称:2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione, 2-[1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl]-5,5-dimethylcyclohexane-1,3-dione

CAS: 774561-57-8
分子式 C31H37NO6
分子量 519.26 g/mol
LogP 5.2507
拓扑极性表面积 100.98 Ų
氢键供体数 1
氢键受体数 6
可旋转键数 3
精确质量 519.2621
重原子数 38
复杂度 1370.9364

化学标识符

CAS 编号 774561-57-8
SMILES CC1=CC(N2C3=C1C=C(C=C3C(C2=O)(C4C(=O)CC(CC4=O)(C)C)C5=C(CC(CC5=O)(C)C)O)OC)(C)C

产品概述

2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione(CAS 774561-57-8),分子式为C31H37NO6,分子量为519.26 g/mol。IUPAC名:2-[3-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-6-methoxy-9,11,11-trimethyl-2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraen-3-yl]-5,5-dimethylcyclohexane-1,3-dione

🧪
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。
查看MSDS →

2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione化学性质概览

XLogP(分配系数)
5.2507
TPSA(拓扑极性表面积)
100.98
氢键供体数
1
氢键受体数
6
可旋转键数
3
重原子数
38
复杂度
1370.9364
精确质量
519.2621
单同位素质量
519.2621
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:2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione

2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione的XLogP值为5.2507,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。 TPSA为100.98 Ų,处于中等极性范围,在透过性和溶解性之间取得平衡。 根据Lipinski五规则,2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione有1个氢键供体和6个氢键受体,可能需要考虑配方优化。

常见问题

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常见问题

2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione的CAS号是多少?

2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione的CAS号为774561-57-8。

2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione的分子式是什么?

2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione的分子式为C31H37NO6。

2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione的分子量是多少?

2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione的分子量为519.26 g/mol。

在哪里可以购买2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione?

您可以直接向科弘生物询价2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione。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2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione的定制合成服务?

是的,科弘生物提供2-(1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-2,4-dihydro-1H-pyrrolo[3,2,1-ij]quinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione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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