Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate
概要:Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate(CAS 543707-17-1)是一种化学化合物,分子式为C18H21NO3S,分子量为331.12 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。
methyl 4,5-dimethyl-2-[(4-propan-2-ylbenzoyl)amino]thiophene-3-carboxylate
又称:methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate, methyl 4,5-dimethyl-2-[(4-propan-2-ylbenzoyl)amino]thiophene-3-carboxylate, METHYL 2-(4-ISOPROPYLBENZAMIDO)-4,5-DIMETHYLTHIOPHENE-3-CARBOXYLATE, methyl 4,5-dimethyl-2-({[4-(propan-2-yl)phenyl]carbonyl}amino)thiophene-3-carboxylate, methyl 4,5-dimethyl-2-{[4-(methylethyl)phenyl]carbonylamino}thiophene-3-carbox ylate
| 分子式 | C18H21NO3S |
|---|---|
| 分子量 | 331.12 g/mol |
| LogP | 4.52724 |
| 拓扑极性表面积 | 55.4 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 4 |
| 可旋转键数 | 4 |
| 精确质量 | 331.1242 |
| 重原子数 | 23 |
| 复杂度 | 729.47015 |
化学标识符
| CAS 编号 | 543707-17-1 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)C(C)C)C |
产品概述
Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate(CAS 543707-17-1),分子式为C18H21NO3S,分子量为331.12 g/mol。IUPAC名:methyl 4,5-dimethyl-2-[(4-propan-2-ylbenzoyl)amino]thiophene-3-carboxylate。
Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate化学性质概览
属性洞察:Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate
Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate的XLogP值为4.52724,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。 Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate的拓扑极性表面积(TPSA)为55.4 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate有1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-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate的CAS号是多少?
Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate的CAS号为543707-17-1。
Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate的分子式是什么?
Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate的分子式为C18H21NO3S。
Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate的分子量是多少?
Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate的分子量为331.12 g/mol。
在哪里可以购买Methyl 2-[(4-isopropylbenzoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate?
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