allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate structure

allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate

概要:allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate(CAS 489422-43-7)是一种化学化合物,分子式为C32H27N3O6S,分子量为581.16 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。

prop-2-enyl 2-[(4E)-4-[hydroxy-(3-methyl-4-phenylmethoxyphenyl)methylidene]-2,3-dioxo-5-pyridin-3-ylpyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

又称:allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate, prop-2-en-1-yl 2-[(3E)-3-{[4-(benzyloxy)-3-methylphenyl](hydroxy)methylidene}-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate, prop-2-enyl 2-[(4E)-4-[hydroxy-(3-methyl-4-phenylmethoxyphenyl)methylidene]-2,3-dioxo-5-pyridin-3-ylpyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

CAS: 489422-43-7
分子式 C32H27N3O6S
分子量 581.16 g/mol
LogP 5.70304
拓扑极性表面积 118.92 Ų
氢键供体数 1
氢键受体数 9
可旋转键数 9
精确质量 581.16205
重原子数 42
复杂度 1697.9258

化学标识符

CAS 编号 489422-43-7
SMILES CC1=C(C=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC=C)C)C4=CN=CC=C4)/O)OCC5=CC=CC=C5

产品概述

allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate(CAS 489422-43-7),分子式为C32H27N3O6S,分子量为581.16 g/mol。IUPAC名:prop-2-enyl 2-[(4E)-4-[hydroxy-(3-methyl-4-phenylmethoxyphenyl)methylidene]-2,3-dioxo-5-pyridin-3-ylpyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

🧪
安全数据表(MSDS / SDS) 在PubChem上查看实验室化学品安全摘要(LCSS)——包含GHS分类、危险说明、急救措施和操作注意事项。
查看MSDS →

allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate化学性质概览

XLogP(分配系数)
5.70304
TPSA(拓扑极性表面积)
118.92
氢键供体数
1
氢键受体数
9
可旋转键数
9
重原子数
42
复杂度
1697.9258
精确质量
581.16205
单同位素质量
581.16205
数据来源: 化学性质数据引用自 PubChem,由美国国家医学图书馆(NLM)下属的国家生物技术信息中心(NCBI)维护的全球最大开放化学数据库。

属性洞察:allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate

allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate的XLogP值为5.70304,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118.92 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,allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate有1个氢键供体和9个氢键受体,可能需要考虑配方优化。

常见问题

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常见问题

allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate的CAS号是多少?

allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate的CAS号为489422-43-7。

allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate的分子式是什么?

allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate的分子式为C32H27N3O6S。

allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate的分子量是多少?

allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate的分子量为581.16 g/mol。

在哪里可以购买allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate?

您可以直接向科弘生物询价allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-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allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate的定制合成服务?

是的,科弘生物提供allyl 2-(3-(4-(benzyloxy)-3-methylbenzoyl)-4-hydroxy-5-oxo-2-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-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。

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