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CAS 105-45-3

methyl 3-oxobutanoate1-Methoxybutane-1,3-dione

登记编号:PALB-052、(IV)1024528-3-a、(II)638294-10-a,(II)638294-10-b

应用背景(按来源药适应症)

乳腺癌哌柏西利非小细胞肺癌普拉替尼甲状腺瘤普拉替尼甲状腺髓样癌普拉替尼收缩性心力衰竭非奈利酮舒张期心力衰竭非奈利酮心脏衰竭非奈利酮慢性肾功能不全非奈利酮糖尿病肾病非奈利酮二型糖尿病非奈利酮

来源药(使用该中间体的合成路线)

品种梯队到期年
哌柏西利PalbociclibTier A · 立即攻坚2027
普拉替尼PralsetinibTier C · 观察 / 贸易2031
非奈利酮FinerenoneTier C · 观察 / 贸易2030

合成路线中的位置(上下游链)

按路线登记顺序排列,左→右为合成方向;高亮为当前 CAS,其余可点击跳转对应档案。

普拉替尼优化路线步数:7总收率:/
Methyl 4-cyano-1-methoxycyclohexane-1-carboxylate→Methyl 4-[imino(methoxy)methyl]-1-methoxycyclohexane-1-carboxylate hydrogen chloride→Methyl trans-4-carbamimidoyl-1-methoxycyclohexane-1-carboxylate→1-Methoxybutane-1,3-dione→Methyl 1-methoxy-4-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)cyclohexane-1-carboxylate→Methyl trans-4-[4-[(methanesulfonyl)oxy]-6-methylpyrimidin-2-yl]-1-methoxycyclohexane-1-carboxylate→3-Amino-5-methylpyrazole→Methyl (1s,4s)-1-methoxy-4-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]cyclohexane-1-carboxylate→(1s,4s)-1-Methoxy-4-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]cyclohexane-1-carboxylic acid→(1S)-1-[6-(4-Fluoro-1H-pyrazol-1-yl)pyridin-3-yl]ethan-1-amine→(1S)-1-[6-(4-Fluoro-1H-pyrazol-1-yl)pyridin-3-yl]ethan-1-amine hydrogen chloride
非奈利酮优化路线步数:4总收率:/
4-Bromo-2-methoxybenzaldehyde→1-Methoxybutane-1,3-dione→Methyl (2Z)-2-[(4-bromo-2-methoxyphenyl)methylidene]-3-oxobutanoate→4-Amino-5-methylpyridin-2(1H)-one→Methyl 4-(4-bromo-2-methoxyphenyl)-5-hydroxy-2,8-dimethyl-1,4-dihydro-1,6-naphthyridine-3-carboxylate→(Diethoxymethoxy)ethane→Methyl 4-(4-bromo-2-methoxyphenyl)-5-ethoxy-2,8-dimethyl-1,4-dihydro-1,6-naphthyridine-3-carboxylate→Methyl (4S)-4-(4-bromo-2-methoxyphenyl)-5-ethoxy-2,8-dimethyl-1,4-dihydro-1,6-naphthyridine-3-carboxylate→Methyl (4S)-4-(4-cyano-2-methoxyphenyl)-5-ethoxy-2,8-dimethyl-1,4-dihydro-1,6-naphthyridine-3-carboxylate→(4S)-4-(4-Cyano-2-methoxyphenyl)-5-ethoxy-2,8-dimethyl-1,4-dihydro-1,6-naphthyridine-3-carboxylic acid
非奈利酮优化路线步数:5总收率:/
1-Methoxybutane-1,3-dione→4-Amino-5-methylpyridin-2(1H)-one→(Diethoxymethoxy)ethane→Methyl (4S)-4-(4-cyano-2-methoxyphenyl)-5-ethoxy-2,8-dimethyl-1,4-dihydro-1,6-naphthyridine-3-carboxylate→3-Fluoro-4-formylbenzonitrile→Methyl 2-[(4-cyano-2-fluorophenyl)methylidene]-3-oxobutanoate→Methyl 4-(4-cyano-2-fluorophenyl)-5-hydroxy-2,8-dimethyl-1,4-dihydro-1,6-naphthyridine-3-carboxylate→Methyl 4-(4-cyano-2-fluorophenyl)-5-ethoxy-2,8-dimethyl-1,4-dihydro-1,6-naphthyridine-3-carboxylate→Methyl (4S)-4-(4-cyano-2-fluorophenyl)-5-ethoxy-2,8-dimethyl-1,4-dihydro-1,6-naphthyridine-3-carboxylate→Natrium methoxide

本站可供应的对应中间体

同 CAS 多家在售供应横向对比;价格区间为供应方挂牌口径,实价以询价确认为准。

供应商产品价格区间最小起订货期资质
Unibest Nantong cGMP Site4-Bromo-2-methoxybenzaldehyde
Pharmaceutical Intermediates
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Unibest Taizhou GMP-like Site4-formyl-3-methoxybenzonitrile
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Qualified Partner — East China API Works4-AMino-5-Methylpyridin-2-ol
Pharmaceutical Intermediates
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Unibest Nantong cGMP Site2-chloro-5-methylpyridin-4-amine
Pharmaceutical Intermediates
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Unibest Taizhou GMP-like Site2-Cyanoethyl 3-oxobutanoate
Pharmaceutical Intermediates
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Qualified Partner — East China API Works2-cyanoethyl 4-(4-cyano-2-methoxyphenyl)-2,8-dimethyl-5-oxo-1,4,5,6-tetrahydro-1,6-naphthyridine-3-carboxylate
Pharmaceutical Intermediates
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Qualified Partner — East China API Works5-broMo-2-chloro-N-cyclopentylpyriMidin-4-aMine
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Unibest Nantong cGMP Site2-chloro-8-cyclopentyl-5-Methylpyrido[2,3-d]pyriMidin-7(8H)-one
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Unibest Taizhou GMP-like Site6-broMo-2-chloro-8-cyclopentyl-5-Methylpyrido[2,3-d]pyriMidin-7(8H)-one
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Qualified Partner — East China API Workstert-Butyl 4-(6-aminopyridin-3-yl)piperazine-1-carboxylate
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Unibest Nantong cGMP SiteTert-butyl 4-(6-nitropyridin-3-yl)piperazine-1-carboxylate
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Unibest Taizhou GMP-like Sitetert-Butyl 4-(6-((6-(1-butoxyvinyl)-8-cyclopentyl-5-methyl-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl)amino)pyridin-3-yl)piperazine-1-carboxylate
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Qualified Partner — East China API WorksPD 0332991 HCl
Pharmaceutical Intermediates
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本页为中间体 CAS 注册档案:同 CAS 的多条路线登记已合并;后续供应商报价与买方需求以该 CAS 为主键撮合。