1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one
概要:1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one(CAS 1190000-47-5)是一种化学化合物,分子式为C21H25N3O2S,分子量为383.17 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-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one
又称:1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one, 3-(2-(cyclohex-1-en-1-yl)ethyl)-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one, 3-[2-(cyclohex-1-en-1-yl)ethyl]-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
| 分子式 | C21H25N3O2S |
|---|---|
| 分子量 | 383.17 g/mol |
| LogP | 3.73709 |
| 拓扑极性表面积 | 70.05 Ų |
| 氢键供体数 | 3 |
| 氢键受体数 | 4 |
| 可旋转键数 | 4 |
| 精确质量 | 383.16675 |
| 重原子数 | 27 |
| 复杂度 | 989.65173 |
化学标识符
| CAS 编号 | 1190000-47-5 |
|---|---|
| SMILES | C1CCC(=CC1)CCN2C(=C(C(=O)NC2=S)C3C4=CC=CC=C4CCN3)O |
产品概述
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one(CAS 1190000-47-5),分子式为C21H25N3O2S,分子量为383.17 g/mol。IUPAC名:1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one。
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one化学性质概览
属性洞察:1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one的XLogP值为3.73709,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70.05 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-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one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
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one的CAS号是多少?
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one的CAS号为1190000-47-5。
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one的分子式是什么?
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one的分子式为C21H25N3O2S。
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one的分子量是多少?
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one的分子量为383.17 g/mol。
在哪里可以购买1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one?
您可以直接向科弘生物询价1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one。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-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one的定制合成服务?
是的,科弘生物提供1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one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。