(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
概要:(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile(CAS 850749-80-3)是一种化学化合物,分子式为C25H21FN2O5S,分子量为480.12 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。
(5Z)-1-(1,1-dioxothiolan-3-yl)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-4-methyl-2,6-dioxopyridine-3-carbonitrile
又称:(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile, (5Z)-1-(1,1-dioxothiolan-3-yl)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-4-methyl-2,6-dioxopyridine-3-carbonitrile, (Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-(4-((4-fluorobenzyl)oxy)benzylidene)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
| 分子式 | C25H21FN2O5S |
|---|---|
| 分子量 | 480.12 g/mol |
| LogP | 3.18408 |
| 拓扑极性表面积 | 104.54 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 6 |
| 可旋转键数 | 5 |
| 精确质量 | 480.1155 |
| 重原子数 | 34 |
| 复杂度 | 1353.5112 |
化学标识符
| CAS 编号 | 850749-80-3 |
|---|---|
| SMILES | CC\1=C(C(=O)N(C(=O)/C1=C\C2=CC=C(C=C2)OCC3=CC=C(C=C3)F)C4CCS(=O)(=O)C4)C#N |
产品概述
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile(CAS 850749-80-3),分子式为C25H21FN2O5S,分子量为480.12 g/mol。IUPAC名:(5Z)-1-(1,1-dioxothiolan-3-yl)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-4-methyl-2,6-dioxopyridine-3-carbonitrile。
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile化学性质概览
属性洞察:(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile的XLogP值为3.18408,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104.54 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,(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile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
常见问题
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile的CAS号是多少?
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile的CAS号为850749-80-3。
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile的分子式是什么?
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile的分子式为C25H21FN2O5S。
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile的分子量是多少?
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile的分子量为480.12 g/mol。
在哪里可以购买(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile?
您可以直接向科弘生物询价(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-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(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile的定制合成服务?
是的,科弘生物提供(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-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。