(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
概要:(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate(CAS 488823-88-7)是一种化学化合物,分子式为C25H25N3O3S,分子量为447.16 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。
propan-2-yl 2-[[(E)-2-cyano-3-(1-methylindol-3-yl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
又称:(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, propan-2-yl 2-[[(E)-2-cyano-3-(1-methylindol-3-yl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, propan-2-yl 2-{[(2E)-2-cyano-3-(1-methyl-1H-indol-3-yl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| 分子式 | C25H25N3O3S |
|---|---|
| 分子量 | 447.16 g/mol |
| LogP | 5.22948 |
| 拓扑极性表面积 | 84.12 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 5 |
| 可旋转键数 | 5 |
| 精确质量 | 447.16165 |
| 重原子数 | 32 |
| 复杂度 | 1273.5632 |
化学标识符
| CAS 编号 | 488823-88-7 |
|---|---|
| SMILES | CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)/C(=C/C3=CN(C4=CC=CC=C43)C)/C#N |
产品概述
(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate(CAS 488823-88-7),分子式为C25H25N3O3S,分子量为447.16 g/mol。IUPAC名:propan-2-yl 2-[[(E)-2-cyano-3-(1-methylindol-3-yl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate。
(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate化学性质概览
属性洞察:(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate的XLogP值为5.22948,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84.12 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,(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate有1个氢键供体和5个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate的CAS号是多少?
(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate的CAS号为488823-88-7。
(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate的分子式是什么?
(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate的分子式为C25H25N3O3S。
(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate的分子量是多少?
(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate的分子量为447.16 g/mol。
在哪里可以购买(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate?
您可以直接向科弘生物询价(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-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(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate的定制合成服务?
是的,科弘生物提供(E)-isopropyl 2-(2-cyano-3-(1-methyl-1H-indol-3-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-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。