![ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate structure](/static/products/488/488861-44-5.png)
ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate
概要：ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate（CAS 488861-44-5）是一种化学化合物，分子式为C20H21F2N3O3S，分子量为421.13 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-[(3,4-difluorobenzoyl)carbamothioylamino]-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate
又称：ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate, ethyl 2-(3-(3,4-difluorobenzoyl)thioureido)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate, ethyl 2-[(3,4-difluorobenzoyl)carbamothioylamino]-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate
| 分子式 | C20H21F2N3O3S |
|---|---|
| 分子量 | 421.13 g/mol |
| LogP | 3.8653 |
| 拓扑极性表面积 | 83.22 Ų |
| 氢键供体数 | 3 |
| 氢键受体数 | 4 |
| 可旋转键数 | 4 |
| 精确质量 | 421.12717 |
| 重原子数 | 29 |
| 复杂度 | 958.68835 |
化学标识符
| CAS 编号 | 488861-44-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C1CCCCC2)NC(=S)NC(=O)C3=CC(=C(C=C3)F)F |
产品概述
ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate（CAS 488861-44-5），分子式为C20H21F2N3O3S，分子量为421.13 g/mol。IUPAC名：ethyl 2-[(3,4-difluorobenzoyl)carbamothioylamino]-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate。
ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate化学性质概览
属性洞察：ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate
ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate的XLogP值为3.8653，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83.22 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，ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate有3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-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate的CAS号是多少？
ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate的CAS号为488861-44-5。
ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate的分子式是什么？
ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate的分子式为C20H21F2N3O3S。
ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate的分子量是多少？
ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate的分子量为421.13 g/mol。
在哪里可以购买ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate？
您可以直接向科弘生物询价ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-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-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate的定制合成服务？
是的，科弘生物提供ethyl 2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-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。