4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
概要:4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile(CAS 865281-88-5)是一种化学化合物,分子式为C25H17N3O5,分子量为439.12 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-imino-2-(6-methoxy-4-oxochromen-3-yl)-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizine-3-carbonitrile
又称:4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile, 4-imino-2-(6-methoxy-4-oxochromen-3-yl)-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizine-3-carbonitrile
| 分子式 | C25H17N3O5 |
|---|---|
| 分子量 | 439.12 g/mol |
| LogP | 3.57305 |
| 拓扑极性表面积 | 110.47 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 7 |
| 可旋转键数 | 2 |
| 精确质量 | 439.11682 |
| 重原子数 | 33 |
| 复杂度 | 1641.645 |
化学标识符
| CAS 编号 | 865281-88-5 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)OC=C(C2=O)C3=C(C(=N)N4CCC5=CC6=C(C=C5C4=C3)OCO6)C#N |
产品概述
4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile(CAS 865281-88-5),分子式为C25H17N3O5,分子量为439.12 g/mol。IUPAC名:4-imino-2-(6-methoxy-4-oxochromen-3-yl)-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizine-3-carbonitrile。
4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile化学性质概览
属性洞察:4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile的XLogP值为3.57305,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110.47 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,4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile有1个氢键供体和7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-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile的CAS号是多少?
4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile的CAS号为865281-88-5。
4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile的分子式是什么?
4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile的分子式为C25H17N3O5。
4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile的分子量是多少?
4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile的分子量为439.12 g/mol。
在哪里可以购买4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile?
您可以直接向科弘生物询价4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile。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4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile的定制合成服务?
是的,科弘生物提供4-imino-2-(6-methoxy-4-oxo-4H-chromen-3-yl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile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。