(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
概要:(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione(CAS 841211-25-4)是一种化学化合物,分子式为C19H29N5O2S,分子量为391.20 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。
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(2-piperazin-1-ylethyliminomethyl)-2-sulfanylidenepyrimidin-4-one
又称:(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, (E)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-(((2-(piperazin-1-yl)ethyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
| 分子式 | C19H29N5O2S |
|---|---|
| 分子量 | 391.20 g/mol |
| LogP | 1.82609 |
| 拓扑极性表面积 | 85.65 Ų |
| 氢键供体数 | 3 |
| 氢键受体数 | 6 |
| 可旋转键数 | 7 |
| 精确质量 | 391.2042 |
| 重原子数 | 27 |
| 复杂度 | 805.2985 |
化学标识符
| CAS 编号 | 841211-25-4 |
|---|---|
| SMILES | C1CCC(=CC1)CCN2C(=C(C(=O)NC2=S)C=NCCN3CCNCC3)O |
产品概述
(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione(CAS 841211-25-4),分子式为C19H29N5O2S,分子量为391.20 g/mol。IUPAC名:1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(2-piperazin-1-ylethyliminomethyl)-2-sulfanylidenepyrimidin-4-one。
(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione化学性质概览
属性洞察:(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione的XLogP值为1.82609,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85.65 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,(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione有3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
(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione的CAS号是多少?
(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione的CAS号为841211-25-4。
(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione的分子式是什么?
(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione的分子式为C19H29N5O2S。
(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione的分子量是多少?
(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione的分子量为391.20 g/mol。
在哪里可以购买(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
您可以直接向科弘生物询价(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione。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(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione的定制合成服务?
是的,科弘生物提供(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione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。