1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione
概要:1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione(CAS 573709-42-9)是一种化学化合物,分子式为C27H24F3N5O6,分子量为571.17 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。
1-[2-(3,4-dimethoxyphenyl)ethyl]-5-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4,6-trione
又称:1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4,6-trione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-2,6-dione, 1-[2-(3,4-DIMETHOXYPHENYL)ETHYL]-5-(5-METHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL)-5-(TRIFLUOROMETHYL)-1H,2H,3H,4H,5H,6H,7H-PYRROLO[2,3-D]PYRIMIDINE-2,4,6-TRIONE
| 分子式 | C27H24F3N5O6 |
|---|---|
| 分子量 | 571.17 g/mol |
| LogP | 2.38442 |
| 拓扑极性表面积 | 140.21 Ų |
| 氢键供体数 | 3 |
| 氢键受体数 | 6 |
| 可旋转键数 | 7 |
| 精确质量 | 571.16785 |
| 重原子数 | 41 |
| 复杂度 | 1837.3215 |
化学标识符
| CAS 编号 | 573709-42-9 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=CC=C2)C3(C4=C(NC3=O)N(C(=O)NC4=O)CCC5=CC(=C(C=C5)OC)OC)C(F)(F)F |
产品概述
1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione(CAS 573709-42-9),分子式为C27H24F3N5O6,分子量为571.17 g/mol。IUPAC名:1-[2-(3,4-dimethoxyphenyl)ethyl]-5-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4,6-trione。
1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione化学性质概览
属性洞察:1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione
1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione的XLogP值为2.38442,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140.21 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,1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione有3个氢键供体和6个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione的CAS号是多少?
1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione的CAS号为573709-42-9。
1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione的分子式是什么?
1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione的分子式为C27H24F3N5O6。
1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione的分子量是多少?
1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione的分子量为571.17 g/mol。
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是的,科弘生物提供1-(3,4-dimethoxyphenethyl)-5-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H,5H,7H)-trione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。