Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate
概要:Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate(CAS 312528-05-5)是一种化学化合物,分子式为C26H22N2O2S2,分子量为458.11 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。
ethyl 2-(phenylcarbamothioylamino)-4-(4-phenylphenyl)thiophene-3-carboxylate
又称:ethyl 2-(phenylcarbamothioylamino)-4-(4-phenylphenyl)thiophene-3-carboxylate, ethyl 4-([1,1'-biphenyl]-4-yl)-2-(3-phenylthioureido)thiophene-3-carboxylate, Ethyl 4-(4-phenylphenyl)-2-(phenylthiocarbamoylamino)thiophene-3-carboxylate, ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate, ETHYL 4-{[1,1'-BIPHENYL]-4-YL}-2-[(PHENYLCARBAMOTHIOYL)AMINO]THIOPHENE-3-CARBOXYLATE
| 分子式 | C26H22N2O2S2 |
|---|---|
| 分子量 | 458.11 g/mol |
| LogP | 7.0677 |
| 拓扑极性表面积 | 50.36 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 4 |
| 可旋转键数 | 6 |
| 精确质量 | 458.11227 |
| 重原子数 | 32 |
| 复杂度 | 1203.8325 |
化学标识符
| CAS 编号 | 312528-05-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3=CC=CC=C3)NC(=S)NC4=CC=CC=C4 |
产品概述
Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate(CAS 312528-05-5),分子式为C26H22N2O2S2,分子量为458.11 g/mol。IUPAC名:ethyl 2-(phenylcarbamothioylamino)-4-(4-phenylphenyl)thiophene-3-carboxylate。
Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate化学性质概览
属性洞察:Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate
Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate的XLogP值为7.0677,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。 Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate的拓扑极性表面积(TPSA)为50.36 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate有2个氢键供体和4个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate的CAS号是多少?
Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate的CAS号为312528-05-5。
Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate的分子式是什么?
Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate的分子式为C26H22N2O2S2。
Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate的分子量是多少?
Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate的分子量为458.11 g/mol。
在哪里可以购买Ethyl 4-(biphenyl-4-yl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate?
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