Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate
概要:Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate(CAS 823825-31-6)是一种化学化合物,分子式为C21H21N3O6S,分子量为443.12 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。
diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate
又称:Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate, diethyl 3-methyl-5-{[(4-oxoquinazolin-3(4H)-yl)acetyl]amino}thiophene-2,4-dicarboxylate, diethyl 3-methyl-5-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)thiophene-2,4-dicarboxylate
| 分子式 | C21H21N3O6S |
|---|---|
| 分子量 | 443.12 g/mol |
| LogP | 2.75852 |
| 拓扑极性表面积 | 116.59 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 8 |
| 可旋转键数 | 7 |
| 精确质量 | 443.1151 |
| 重原子数 | 31 |
| 复杂度 | 1213.5358 |
化学标识符
| CAS 编号 | 823825-31-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN2C=NC3=CC=CC=C3C2=O |
产品概述
Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate(CAS 823825-31-6),分子式为C21H21N3O6S,分子量为443.12 g/mol。IUPAC名:diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate。
Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate化学性质概览
属性洞察:Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate
Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate的XLogP值为2.75852,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 TPSA为116.59 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,Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate有1个氢键供体和8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
Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate的CAS号是多少?
Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate的CAS号为823825-31-6。
Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate的分子式是什么?
Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate的分子式为C21H21N3O6S。
Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate的分子量是多少?
Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate的分子量为443.12 g/mol。
在哪里可以购买Diethyl 3-methyl-5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate?
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