2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone
概要:2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone(CAS 799781-31-0)是一种化学化合物,分子式为C29H29FN2O3S2,分子量为536.16 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-[[5-(4-butoxyphenyl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl]sulfanyl]-1-(4-fluorophenyl)ethanone
又称:2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone, 2-{[2-(4-butoxyphenyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
| 分子式 | C29H29FN2O3S2 |
|---|---|
| 分子量 | 536.16 g/mol |
| LogP | 7.5026 |
| 拓扑极性表面积 | 61.31 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 7 |
| 可旋转键数 | 9 |
| 精确质量 | 536.16034 |
| 重原子数 | 37 |
| 复杂度 | 1416.1185 |
化学标识符
| CAS 编号 | 799781-31-0 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C2=NC3=C(C4=C(S3)COC(C4)(C)C)C(=N2)SCC(=O)C5=CC=C(C=C5)F |
产品概述
2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone(CAS 799781-31-0),分子式为C29H29FN2O3S2,分子量为536.16 g/mol。IUPAC名:2-[[5-(4-butoxyphenyl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl]sulfanyl]-1-(4-fluorophenyl)ethanone。
2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone化学性质概览
属性洞察:2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone
2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone的XLogP值为7.5026,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61.31 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-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone有0个氢键供体和7个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone的CAS号是多少?
2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone的CAS号为799781-31-0。
2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone的分子式是什么?
2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone的分子式为C29H29FN2O3S2。
2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone的分子量是多少?
2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone的分子量为536.16 g/mol。
在哪里可以购买2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone?
您可以直接向科弘生物询价2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone。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-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone的定制合成服务?
是的,科弘生物提供2-((2-(4-butoxyphenyl)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-fluorophenyl)ethanone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。