[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate
概要:[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate(CAS 848297-88-1)是一种化学化合物,分子式为C23H29N3O4S,分子量为443.19 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。
[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzoate
又称:[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate|[(1-cyanocyclohexyl)-methyl-carbamoyl]methyl 2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoate|[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzoate|MLS002161061|SMR001243488|EN300-26681019
| 分子式 | C23H29N3O4S |
|---|---|
| 分子量 | 443.19 g/mol |
| LogP | 3.24278 |
| 拓扑极性表面积 | 90.71 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 6 |
| 可旋转键数 | 7 |
| 精确质量 | 443.18787 |
| 重原子数 | 31 |
| 复杂度 | 854.62274 |
化学标识符
| CAS 编号 | 848297-88-1 |
|---|---|
| SMILES | CN(C(=O)COC(=O)C1=CC=CC=C1SCC(=O)N2CCCC2)C3(CCCCC3)C#N |
产品概述
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate(CAS 848297-88-1),分子式为C23H29N3O4S,分子量为443.19 g/mol。IUPAC名:[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzoate。
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate化学性质概览
属性洞察:[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate的XLogP值为3.24278,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90.71 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,[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate有0个氢键供体和6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
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate的CAS号是多少?
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate的CAS号为848297-88-1。
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate的分子式是什么?
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate的分子式为C23H29N3O4S。
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate的分子量是多少?
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate的分子量为443.19 g/mol。
在哪里可以购买[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate?
您可以直接向科弘生物询价[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate。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[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate的定制合成服务?
是的,科弘生物提供[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}benzoate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。