ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate
概要:ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate(CAS 111853-35-1)是一种化学化合物,分子式为C17H18N4O3S,分子量为358.11 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 6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxylate
又称:ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate, ethyl 6-((2-amino-2-oxoethyl)thio)-5-cyano-2-methyl-1,4-dihydro-[4,4'-bipyridine]-3-carboxylate, ethyl 6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxylate, ethyl 6'-carbamoylmethylthio-5'-cyano-2'-methyl-1',4'-dihydro-4,4'-bipyridine-3'-carboxylate, ETHYL 6-[(CARBAMOYLMETHYL)SULFANYL]-5-CYANO-2-METHYL-1,4-DIHYDRO-[4,4'-BIPYRIDINE]-3-CARBOXYLATE
| 分子式 | C17H18N4O3S |
|---|---|
| 分子量 | 358.11 g/mol |
| LogP | 1.0 |
| 拓扑极性表面积 | 143.0 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 7 |
| 可旋转键数 | 7 |
| 精确质量 | 358.10995 |
| 重原子数 | 25 |
| 复杂度 | 656.0 |
化学标识符
| CAS 编号 | 111853-35-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C2=CC=NC=C2)C#N)SCC(=O)N)C |
| InChIKey | PEUMQBPPVOHRQO-UHFFFAOYSA-N |
产品概述
ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate(CAS 111853-35-1),分子式为C17H18N4O3S,分子量为358.11 g/mol。IUPAC名:ethyl 6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxylate。
ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate化学性质概览
属性洞察:ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate
ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate的XLogP值为1.0,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 TPSA为143.0 Ų,极性较高,提示该化合物膜透过性可能受限但水溶性较好。 根据Lipinski五规则,ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate有2个氢键供体和7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 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate的CAS号是多少?
ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate的CAS号为111853-35-1。
ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate的分子式是什么?
ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate的分子式为C17H18N4O3S。
ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate的分子量是多少?
ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate的分子量为358.11 g/mol。
在哪里可以购买ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate?
您可以直接向科弘生物询价ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-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 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate的定制合成服务?
是的,科弘生物提供ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-1,4-dihydro-4,4'-bipyridine-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。