Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate
概要:Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate(CAS 540789-59-1)是一种化学化合物,分子式为C15H15ClN2O3S,分子量为338.05 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。
methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate
又称:methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate, methyl 2-{[(3-chloroanilino)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate, methyl 2-{[(3-chlorophenyl)amino]carbonylamino}-4,5-dimethylthiophene-3-carbox ylate, methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-4,5-dimethylthiophene-3-carboxylate
| 分子式 | C15H15ClN2O3S |
|---|---|
| 分子量 | 338.05 g/mol |
| LogP | 4.3 |
| 拓扑极性表面积 | 95.7 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 4 |
| 可旋转键数 | 4 |
| 精确质量 | 338.0492 |
| 重原子数 | 22 |
| 复杂度 | 424.0 |
化学标识符
| CAS 编号 | 540789-59-1 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)NC2=CC(=CC=C2)Cl)C |
| InChIKey | SQGYGJYLBBNULC-UHFFFAOYSA-N |
产品概述
Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate(CAS 540789-59-1),分子式为C15H15ClN2O3S,分子量为338.05 g/mol。IUPAC名:methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate。
Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate化学性质概览
属性洞察:Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate
Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate的XLogP值为4.3,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95.7 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,Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate有2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
Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate的CAS号是多少?
Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate的CAS号为540789-59-1。
Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate的分子式是什么?
Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate的分子式为C15H15ClN2O3S。
Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate的分子量是多少?
Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate的分子量为338.05 g/mol。
在哪里可以购买Methyl 2-[(3-chlorophenyl)carbamoylamino]-4,5-dimethylthiophene-3-carboxylate?
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