5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride
概要:5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride(CAS 959576-72-8)是一种化学化合物,分子式为C16H19ClN2O,分子量为290.12 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-tert-butyl-1-[(3-methylphenyl)methyl]pyrazole-5-carbonyl chloride
又称:3-tert-Butyl-1-(3-methylphenyl)-1H-pyrazole-5-carbonyl chloride, 5-tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride, 5-tert-Butyl-2-(3-methyl-benzyl)-2H-pyrazole-3-carbonyl chloride, 5-tert-butyl-2-(m-tolylmethyl)pyrazole-3-carbonyl chloride, 3-(tert-Butyl)-1-(3-methylbenzyl)-1H-pyrazole-5-carbonyl chloride
| 分子式 | C16H19ClN2O |
|---|---|
| 分子量 | 290.12 g/mol |
| LogP | 3.91632 |
| 拓扑极性表面积 | 34.89 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 3 |
| 精确质量 | 290.1186 |
| 重原子数 | 20 |
| 复杂度 | 638.1667 |
化学标识符
| CAS 编号 | 959576-72-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CN2C(=CC(=N2)C(C)(C)C)C(=O)Cl |
产品概述
5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride(CAS 959576-72-8),分子式为C16H19ClN2O,分子量为290.12 g/mol。IUPAC名:3-tert-butyl-1-[(3-methylphenyl)methyl]pyrazole-5-carbonyl chloride。
5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride化学性质概览
属性洞察:5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride
5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride的XLogP值为3.91632,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。 5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride的拓扑极性表面积(TPSA)为34.89 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride有0个氢键供体和2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
5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride的CAS号是多少?
5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride的CAS号为959576-72-8。
5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride的分子式是什么?
5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride的分子式为C16H19ClN2O。
5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride的分子量是多少?
5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride的分子量为290.12 g/mol。
在哪里可以购买5-Tert-butyl-2-[(3-methylphenyl)methyl]pyrazole-3-carbonyl chloride?
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