(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one
概要:(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one(CAS 840510-20-5)是一种化学化合物,分子式为C26H25N5O3S,分子量为487.17 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。
(6Z)-5-imino-6-[[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-2-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
又称:(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one, (6Z)-5-imino-6-[[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-2-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, (6Z)-5-imino-6-{4-[(3-methylbenzyl)oxy]benzylidene}-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
| 分子式 | C26H25N5O3S |
|---|---|
| 分子量 | 487.17 g/mol |
| LogP | 4.20569 |
| 拓扑极性表面积 | 98.42 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 6 |
| 可旋转键数 | 6 |
| 精确质量 | 487.16782 |
| 重原子数 | 35 |
| 复杂度 | 1276.1473 |
化学标识符
| CAS 编号 | 840510-20-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)COC2=CC=C(C=C2)/C=C\3/C(=N)N4C(=NC3=O)SC(=N4)CC(=O)N5CCCC5 |
产品概述
(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one(CAS 840510-20-5),分子式为C26H25N5O3S,分子量为487.17 g/mol。IUPAC名:(6Z)-5-imino-6-[[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-2-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one。
(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one化学性质概览
属性洞察:(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one
(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one的XLogP值为4.20569,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98.42 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,(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one有1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
(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one的CAS号是多少?
(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one的CAS号为840510-20-5。
(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one的分子式是什么?
(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one的分子式为C26H25N5O3S。
(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one的分子量是多少?
(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one的分子量为487.17 g/mol。
在哪里可以购买(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one?
您可以直接向科弘生物询价(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-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(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one的定制合成服务?
是的,科弘生物提供(Z)-5-imino-6-(4-((3-methylbenzyl)oxy)benzylidene)-2-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-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。