3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile
概要:3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile(CAS 373617-88-0)是一种化学化合物,分子式为C21H21N3O2S2,分子量为411.11 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。
3-[(12-ethyl-12-methyl-3-oxo-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]propanenitrile
又称:3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile, 3-[(6-ethyl-6-methyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanenitrile
| 分子式 | C21H21N3O2S2 |
|---|---|
| 分子量 | 411.11 g/mol |
| LogP | 4.69438 |
| 拓扑极性表面积 | 67.91 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 6 |
| 可旋转键数 | 5 |
| 精确质量 | 411.1075 |
| 重原子数 | 28 |
| 复杂度 | 1114.6116 |
化学标识符
| CAS 编号 | 373617-88-0 |
|---|---|
| SMILES | CCC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCCC#N)C4=CC=CC=C4)C |
产品概述
3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile(CAS 373617-88-0),分子式为C21H21N3O2S2,分子量为411.11 g/mol。IUPAC名:3-[(12-ethyl-12-methyl-3-oxo-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]propanenitrile。
3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile化学性质概览
属性洞察:3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile
3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile的XLogP值为4.69438,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67.91 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,3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile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
3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile的CAS号是多少?
3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile的CAS号为373617-88-0。
3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile的分子式是什么?
3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile的分子式为C21H21N3O2S2。
3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile的分子量是多少?
3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile的分子量为411.11 g/mol。
在哪里可以购买3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile?
您可以直接向科弘生物询价3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile。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3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile的定制合成服务?
是的,科弘生物提供3-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanenitrile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。