3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide
概要:3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide(CAS 154807-57-5)是一种化学化合物,分子式为C17H22N4O2S2,分子量为378.12 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。
5-(butylcarbamoylamino)-3-methyl-N-(4-methylsulfanylphenyl)-1,2-thiazole-4-carboxamide
又称:3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide, 4-Isothiazolecarboxamide, 5-(((butylamino)carbonyl)amino)-3-methyl-N-(4-(methylthio)phenyl)-, 5-(((Butylamino)carbonyl)amino)-3-methyl-N-(4-(methylthio)phenyl)-4-isothiazolecarboxamide, 5-[(BUTYLCARBAMOYL)AMINO]-3-METHYL-N-[4-(METHYLSULFANYL)PHENYL]-1,2-THIAZOLE-4-CARBOXAMIDE, 5-(3-Butylureido)-N-[4-(methylthio)phenyl]-3-methylisothiazole-4-carboxamide
| 分子式 | C17H22N4O2S2 |
|---|---|
| 分子量 | 378.12 g/mol |
| LogP | 4.34732 |
| 拓扑极性表面积 | 83.12 Ų |
| 氢键供体数 | 3 |
| 氢键受体数 | 5 |
| 可旋转键数 | 7 |
| 精确质量 | 378.1184 |
| 重原子数 | 25 |
| 复杂度 | 728.74915 |
化学标识符
| CAS 编号 | 154807-57-5 |
|---|---|
| SMILES | CCCCNC(=O)NC1=C(C(=NS1)C)C(=O)NC2=CC=C(C=C2)SC |
产品概述
3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide(CAS 154807-57-5),分子式为C17H22N4O2S2,分子量为378.12 g/mol。IUPAC名:5-(butylcarbamoylamino)-3-methyl-N-(4-methylsulfanylphenyl)-1,2-thiazole-4-carboxamide。
3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide化学性质概览
属性洞察:3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide
3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide的XLogP值为4.34732,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。 TPSA为83.12 Ų,处于中等极性范围,在透过性和溶解性之间取得平衡。 根据Lipinski五规则,3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide有3个氢键供体和5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-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide的CAS号是多少?
3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide的CAS号为154807-57-5。
3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide的分子式是什么?
3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide的分子式为C17H22N4O2S2。
3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide的分子量是多少?
3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide的分子量为378.12 g/mol。
在哪里可以购买3-Methyl-5-n-butylureidoisothiazole-4-carboxylic acid p-methylthioanilide?
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