![ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate structure](/static/products/5903/590354-79-3.webp)
ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate
概要：ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate（CAS 590354-79-3）是一种化学化合物，分子式为C20H23ClN2O2S2，分子量为422.09 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。
ethyl 2-[(3-chlorophenyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
又称：ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate, ethyl 2-(3-(3-chlorophenyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate, ethyl 2-[(3-chlorophenyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate, ethyl 2-{[(3-chlorophenyl)carbamothioyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
| 分子式 | C20H23ClN2O2S2 |
|---|---|
| 分子量 | 422.09 g/mol |
| LogP | 6.0461 |
| 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 | 4 |
| 精确质量 | 422.08896 |
| 重原子数 | 27 |
| 复杂度 | 835.38434 |
化学标识符
| CAS 编号 | 590354-79-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCCCC2)NC(=S)NC3=CC(=CC=C3)Cl |
产品概述
ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate（CAS 590354-79-3），分子式为C20H23ClN2O2S2，分子量为422.09 g/mol。IUPAC名：ethyl 2-[(3-chlorophenyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate。
ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate化学性质概览
属性洞察：ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate
ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate的XLogP值为6.0461，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-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]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 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]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 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate的CAS号是多少？
ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate的CAS号为590354-79-3。
ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate的分子式是什么？
ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate的分子式为C20H23ClN2O2S2。
ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate的分子量是多少？
ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate的分子量为422.09 g/mol。
在哪里可以购买ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate？
您可以直接向科弘生物询价ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-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ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-b]thiophene-3-carboxylate的定制合成服务？
是的，科弘生物提供ethyl 2-({[(3-chlorophenyl)amino]thioxomethyl}amino)-4,5,6,7,8,9-hexahydrocycl oocta[2,1-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。