3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester
概要:3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester(CAS 91857-69-1)是一种化学化合物,分子式为C15H19N3O2,分子量为273.15 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。
ethyl 4-(dimethylamino)-1-methyl-5-phenylpyrazole-3-carboxylate
又称:3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester, Ethyl 4-dimethylamino-5-phenyl-1-methyl-(1H)-pyrazole-3-carboxylate, 4-(Dimethylamino)-1-methyl-5-phenyl-3-pyrazolecarboxylic acid ethyl ester, 1H-Pyrazole-3-carboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester, ethyl 4-(dimethylamino)-1-methyl-5-phenylpyrazole-3-carboxylate
| 分子式 | C15H19N3O2 |
|---|---|
| 分子量 | 273.15 g/mol |
| LogP | 2.3298 |
| 拓扑极性表面积 | 47.36 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 4 |
| 可旋转键数 | 4 |
| 精确质量 | 273.14774 |
| 重原子数 | 20 |
| 复杂度 | 603.08124 |
化学标识符
| CAS 编号 | 91857-69-1 |
|---|---|
| SMILES | CCOC(=O)C1=NN(C(=C1N(C)C)C2=CC=CC=C2)C |
产品概述
3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester(CAS 91857-69-1),分子式为C15H19N3O2,分子量为273.15 g/mol。IUPAC名:ethyl 4-(dimethylamino)-1-methyl-5-phenylpyrazole-3-carboxylate。
3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester化学性质概览
属性洞察:3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester
3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester的XLogP值为2.3298,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester的拓扑极性表面积(TPSA)为47.36 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester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
3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester的CAS号是多少?
3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester的CAS号为91857-69-1。
3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester的分子式是什么?
3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester的分子式为C15H19N3O2。
3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester的分子量是多少?
3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester的分子量为273.15 g/mol。
在哪里可以购买3-Pyrazolecarboxylic acid, 4-(dimethylamino)-1-methyl-5-phenyl-, ethyl ester?
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