methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate
概要:methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate(CAS 957333-68-5)是一种化学化合物,分子式为C29H31N5O3S2,分子量为561.19 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 5-(diethylcarbamoyl)-2-[(1,3-diphenylpyrazol-4-yl)methylcarbamothioylamino]-4-methylthiophene-3-carboxylate
又称:methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate, methyl 5-(diethylcarbamoyl)-2-(3-((1,3-diphenyl-1H-pyrazol-4-yl)methyl)thioureido)-4-methylthiophene-3-carboxylate, methyl 5-(diethylcarbamoyl)-2-[(1,3-diphenylpyrazol-4-yl)methylcarbamothioylamino]-4-methylthiophene-3-carboxylate, methyl 5-(N,N-diethylcarbamoyl)-2-[({[(1,3-diphenylpyrazol-4-yl)methyl]amino}t hioxomethyl)amino]-4-methylthiophene-3-carboxylate
| 分子式 | C29H31N5O3S2 |
|---|---|
| 分子量 | 561.19 g/mol |
| LogP | 5.66442 |
| 拓扑极性表面积 | 88.49 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 6 |
| 可旋转键数 | 9 |
| 精确质量 | 561.1868 |
| 重原子数 | 39 |
| 复杂度 | 1461.0768 |
化学标识符
| CAS 编号 | 957333-68-5 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC)C |
产品概述
methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate(CAS 957333-68-5),分子式为C29H31N5O3S2,分子量为561.19 g/mol。IUPAC名:methyl 5-(diethylcarbamoyl)-2-[(1,3-diphenylpyrazol-4-yl)methylcarbamothioylamino]-4-methylthiophene-3-carboxylate。
methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate化学性质概览
属性洞察:methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate
methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate的XLogP值为5.66442,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88.49 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 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate有2个氢键供体和6个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate的CAS号是多少?
methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate的CAS号为957333-68-5。
methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate的分子式是什么?
methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate的分子式为C29H31N5O3S2。
methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate的分子量是多少?
methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate的分子量为561.19 g/mol。
在哪里可以购买methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate?
您可以直接向科弘生物询价methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。
科弘生物是否提供methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate的定制合成服务?
是的,科弘生物提供methyl 5-(diethylcarbamoyl)-2-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-4-methylthiophene-3-carboxylate及相关化合物的定制合成服务。请联系我们并告知您的具体需求,包括数量、纯度和交期。