4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
概要:4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate(CAS 320423-21-0)是一种化学化合物,分子式为C13H11F3N2O3,分子量为300.07 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。
(4-methoxyphenyl) 1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylate
又称:4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate, (4-methoxyphenyl) 1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylate
| 分子式 | C13H11F3N2O3 |
|---|---|
| 分子量 | 300.07 g/mol |
| LogP | 2.6667 |
| 拓扑极性表面积 | 53.35 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 4 |
| 可旋转键数 | 3 |
| 精确质量 | 300.07217 |
| 重原子数 | 21 |
| 复杂度 | 647.6714 |
化学标识符
| CAS 编号 | 320423-21-0 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(F)(F)F)C(=O)OC2=CC=C(C=C2)OC |
产品概述
4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate(CAS 320423-21-0),分子式为C13H11F3N2O3,分子量为300.07 g/mol。IUPAC名:(4-methoxyphenyl) 1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylate。
4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate化学性质概览
属性洞察:4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate的XLogP值为2.6667,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate的拓扑极性表面积(TPSA)为53.35 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate有0个氢键供体和4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
4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate的CAS号是多少?
4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate的CAS号为320423-21-0。
4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate的分子式是什么?
4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate的分子式为C13H11F3N2O3。
4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate的分子量是多少?
4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate的分子量为300.07 g/mol。
在哪里可以购买4-methoxyphenyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate?
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