(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
概要:(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione(CAS 892623-43-7)是一种化学化合物,分子式为C24H25N7O5S,分子量为523.16 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。
8'-[(1-cyclopropyl-6-hydroxy-4-oxo-2-sulfanylidenepyrimidin-5-yl)methylideneamino]-3'-methylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione
又称:(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (Z)-8-(((1-cyclopropyl-2-mercapto-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene)methyl)amino)-3-methyl-1,2,3,4,4a,6-hexahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(3'H)-trione, 8'-[(1-cyclopropyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]-3'-methylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione
| 分子式 | C24H25N7O5S |
|---|---|
| 分子量 | 523.16 g/mol |
| LogP | 0.72589 |
| 拓扑极性表面积 | 152.13 Ų |
| 氢键供体数 | 4 |
| 氢键受体数 | 9 |
| 可旋转键数 | 3 |
| 精确质量 | 523.1638 |
| 重原子数 | 37 |
| 复杂度 | 1487.7811 |
化学标识符
| CAS 编号 | 892623-43-7 |
|---|---|
| SMILES | CN1CCN2C(C1)C3(CC4=C2C=CC(=C4)N=CC5=C(N(C(=S)NC5=O)C6CC6)O)C(=O)NC(=O)NC3=O |
产品概述
(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione(CAS 892623-43-7),分子式为C24H25N7O5S,分子量为523.16 g/mol。IUPAC名:8'-[(1-cyclopropyl-6-hydroxy-4-oxo-2-sulfanylidenepyrimidin-5-yl)methylideneamino]-3'-methylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione。
(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione化学性质概览
属性洞察:(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione的XLogP值为0.72589,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 TPSA为152.13 Ų,极性较高,提示该化合物膜透过性可能受限但水溶性较好。 根据Lipinski五规则,(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione有4个氢键供体和9个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione的CAS号是多少?
(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione的CAS号为892623-43-7。
(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione的分子式是什么?
(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione的分子式为C24H25N7O5S。
(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione的分子量是多少?
(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione的分子量为523.16 g/mol。
在哪里可以购买(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
您可以直接向科弘生物询价(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-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(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione的定制合成服务?
是的,科弘生物提供(5Z)-1-cyclopropyl-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-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。