Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
概要:Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate(CAS 313967-36-1)是一种化学化合物,分子式为C17H17NO3S,分子量为315.09 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-benzamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
又称:BAS 01039260, J2.131.554K, AB00085963-01, methyl 2-benzamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, METHYL 2-(BENZOYLAMINO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE
| 分子式 | C17H17NO3S |
|---|---|
| 分子量 | 315.09 g/mol |
| LogP | 4.4 |
| 拓扑极性表面积 | 83.6 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 4 |
| 可旋转键数 | 4 |
| 精确质量 | 315.09293 |
| 重原子数 | 22 |
| 复杂度 | 422.0 |
化学标识符
| CAS 编号 | 313967-36-1 |
|---|---|
| SMILES | COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=CC=C3 |
| InChIKey | IENRFPGDTRVDHK-UHFFFAOYSA-N |
产品概述
Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate(CAS 313967-36-1),分子式为C17H17NO3S,分子量为315.09 g/mol。IUPAC名:methyl 2-benzamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate。
Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate化学性质概览
属性洞察:Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate的XLogP值为4.4,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83.6 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-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate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-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate的CAS号是多少?
Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate的CAS号为313967-36-1。
Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate的分子式是什么?
Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate的分子式为C17H17NO3S。
Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate的分子量是多少?
Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate的分子量为315.09 g/mol。
在哪里可以购买Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate?
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科弘生物是否提供Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate的定制合成服务?
是的,科弘生物提供Methyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-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。