Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate
概要:Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate(CAS 544661-37-2)是一种化学化合物,分子式为C14H14ClNO3S,分子量为311.04 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-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]acetate
又称:ethyl 2-(3-chloro-6-methylbenzo[b]thiophene-2-carboxamido)acetate, ethyl {[(3-chloro-6-methyl-1-benzothien-2-yl)carbonyl]amino}acetate, ethyl 2-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]acetate, ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate, ethyl N-[(3-chloro-6-methyl-1-benzothiophen-2-yl)carbonyl]glycinate
| 分子式 | C14H14ClNO3S |
|---|---|
| 分子量 | 311.04 g/mol |
| LogP | 3.15602 |
| 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 | 311.0383 |
| 重原子数 | 20 |
| 复杂度 | 665.7279 |
化学标识符
| CAS 编号 | 544661-37-2 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)C1=C(C2=C(S1)C=C(C=C2)C)Cl |
产品概述
Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate(CAS 544661-37-2),分子式为C14H14ClNO3S,分子量为311.04 g/mol。IUPAC名:ethyl 2-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]acetate。
Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate化学性质概览
属性洞察:Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate
Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate的XLogP值为3.15602,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 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate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,Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate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
Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate的CAS号是多少?
Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate的CAS号为544661-37-2。
Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate的分子式是什么?
Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate的分子式为C14H14ClNO3S。
Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate的分子量是多少?
Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate的分子量为311.04 g/mol。
在哪里可以购买Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate?
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科弘生物是否提供Ethyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]acetate的定制合成服务?
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