<1S-(1α,2α,3α,4α)>-2-<<3-(4-carboxy-2-oxazolyl)-7-oxabicyclo<2.2.1>hept-2-yl>methyl>benzenepropanoic acid methyl ester | 142757-96-8
中文名称
——
中文别名
——
英文名称
<1S-(1α,2α,3α,4α)>-2-<<3-(4-carboxy-2-oxazolyl)-7-oxabicyclo<2.2.1>hept-2-yl>methyl>benzenepropanoic acid methyl ester
英文别名
2-[(1R,2S,3R,4S)-3-[[2-(3-methoxy-3-oxopropyl)phenyl]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]-1,3-oxazole-4-carboxylic acid
CAS
142757-96-8
化学式
C21H23NO6
mdl
——
分子量
385.417
InChiKey
HOOGGUNGSNLYTI-RMRDIRSESA-N
BEILSTEIN
——
EINECS
——
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物化性质
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计算性质
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ADMET
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安全信息
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SDS
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制备方法与用途
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上下游信息
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文献信息
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表征谱图
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同类化合物
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相关功能分类
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相关结构分类
计算性质
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辛醇/水分配系数(LogP)：2.8
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重原子数：28
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可旋转键数：8
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环数：4.0
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sp3杂化的碳原子比例：0.48
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拓扑面积：98.9
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氢给体数：1
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氢受体数：7
上下游信息
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上游原料
中文名称 英文名称 CAS号 化学式 分子量 —— <1S-(1α,2α,3α,4α)>-2-<<3-<4-<(phenylmethoxy)carbonyl>-2-oxazolyl>-7-oxabicyclo<2.2.1>hept-2-yl>methyl>benzenepropanoic acid methyl ester 142757-94-6 C28H29NO6 475.541 -
下游产品
中文名称 英文名称 CAS号 化学式 分子量 —— <1S-(1α,2α,3α,4α)>-2-<<3-<4-(hydroxymethyl)-2-oxazolyl>-7-oxabicyclo<2.2.1>hept-2-yl>methyl>benzenepropanoic acid methyl ester 149080-22-8 C21H25NO5 371.433 —— 4-cyclohexylbutyl 2-[(1R,2S,3R,4S)-3-[[2-(3-oxo-3-phenylmethoxypropyl)phenyl]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]-1,3-oxazole-4-carboxylate 149079-67-4 C37H45NO6 599.767 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-(4-carbamoyl-1,3-oxazol-2-yl)-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149079-91-4 C21H24N2O5 384.432 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-(4-carbonochloridoyl-1,3-oxazol-2-yl)-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 142757-98-0 C21H22ClNO5 403.862 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(methylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149079-92-5 C22H26N2O5 398.459 —— <1S-(1α,2α,3α,4α)>-2-<<3-<4-(6-cyclohexyl-1-oxohexyl)-2-oxazolyl>-7-oxabicyclo<2.2.1>hept-2-yl>methyl>benzenepropanoic acid methyl ester 144380-59-6 C32H43NO5 521.697 —— [1S-(1α,2α,3α,4α)]-2-[[3-[4-[[(1-Methylethyl)amino]-carbonyl]-2-oxazolyl]-7-oxabicyclo[2.2.1]hept-2-yl]-methyl]benzenepropanoic acid, methyl ester 149080-01-3 C24H30N2O5 426.513 —— [1S-(1α,2α,3α,4α)]-2-[[3-[4-[(Propylamino)carbonyl]-2-oxazolyl]-7-oxabicyclo[2.2.1]hept-2-yl]methyl]benzenepropanoic acid, methyl ester 149079-93-6 C24H30N2O5 426.513 —— <1S-(1α,2α,3α,4α)>-2-<<3-<4-<(pentylamino)carbonyl>-2-oxazolyl>-7-oxabicyclo<2.2.1>hept-2-yl>methyl>benzenepropanoic acid methyl ester 142663-84-1 C26H34N2O5 454.566 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(heptylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149079-95-8 C28H38N2O5 482.62 —— [1S-(1α,2α,3α,4α)]-2-[[3-[4-[[(5,5-Dimethylhexyl)amino]carbonyl]-2-oxazolyl]-7-oxabicyclo[2.2.1]hept-2-yl]methyl]benzenepropanoic acid, methyl ester 149080-04-6 C29H40N2O5 496.647 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(tert-butylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149080-02-4 C25H32N2O5 440.539 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(5-hydroxypentylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149079-99-2 C26H34N2O6 470.566 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(decylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149079-96-9 C31H44N2O5 524.701 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(2-phenylethylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149080-11-5 C29H32N2O5 488.583 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(3,3-dimethylbutylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149080-03-5 C27H36N2O5 468.593 伊非曲班 Ifetroban 143443-90-7 C25H32N2O5 440.539 —— <1S-(1α,2α,3α,4α)>-2-<<3-<4-<<(4-cyclohexylbutyl)amino>carbonyl>-2-oxazolyl>-7-oxabicyclo<2.2.1>hept-2-yl>methyl>benzenepropanoic acid methyl ester 142663-83-0 C31H42N2O5 522.685 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(4-phenylbutylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149080-12-6 C31H36N2O5 516.637 —— <1S-(1α,2α,3α,4α)>-2-<<3-<4-<<(4-cyclohexylbutyl)amino>carbonyl>-2-oxazolyl>-7-oxabicyclo<2.2.1>hept-2-yl>methyl>benzenepropanoic acid ethyl ester 149117-75-9 C32H44N2O5 536.712 —— [1S(1α,2α,3α,4α)]-2-[[3-[4-[[(2-Phenylethyl)amino]-carbonyl]-2-oxazolyl]-7-oxabicyclo[2.2.1]hept-2-yl]methyl]benzenepropanoic acid —— C28H30N2O5 474.557 —— SQ 33961 139067-88-2 C30H40N2O5 508.658 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(2-cyclohexylethylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149080-06-8 C29H38N2O5 494.631 —— [1S-(1α,2α,3α,4α)]-2-[[3-[4-[[(1-Piperidinylbutyl)amino]carbonyl]-2-oxazolyl]-7-oxabicyclo[2.2.1]hept-2-yl]methyl]benzenepropanoic acid, methyl ester 149080-20-6 C30H41N3O5 523.673 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(5,5,5-trifluoropentylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149079-98-1 C26H31F3N2O5 508.538 —— [1S-(1α,2α,3α,4α)]-2-[[3-[4-[[(1,1-Dimethylpropyl)amino]carbonyl]-2-oxazolyl]-7-oxabicyclo[2.2.1]hept-2-yl]methyl]benzene-propanoic acid, methyl ester 149080-00-2 C26H34N2O5 454.566 —— [1S-(1α,2α,3α,4α)]-2-[[3-[4-[[[2-(4-Chlorophenyl)ethyl]amino]carbonyl]-2-oxazolyl]-7-oxabicyclo[2.2.1]hept-2-yl]methyl]benzenepropanoic acid, methyl ester 142663-90-9 C29H31ClN2O5 523.029 —— [1S-(1α,2α,3α,4α)]-2-[[3-[4-[[(5-Carboxy-5-methylhexyl)amino]carbonyl]-2-oxazolyl]-7-oxabicyclo[2.2.1]hept-2-yl]-methyl]benzenepropanoic acid, methyl ester 149080-19-3 C29H38N2O7 526.63 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-[4-(4-chlorophenyl)butylcarbamoyl]-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 142757-95-7 C31H35ClN2O5 551.082 —— [1S-(1α,2α,3α,4α)]-2-[[3-[4-[(Cyclohexylamino)-carbonyl]-2-oxazolyl]-7-oxabicyclo[2.2.1]hept-2-yl]methyl]benzenepropanoic acid, methyl ester 149080-05-7 C27H34N2O5 466.577 —— methyl 3-[2-[[(1S,2R,3S,4R)-3-[4-(phenylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoate 149080-08-0 C27H28N2O5 460.53 —— [1S-(1α,2α,3α,4α)]-2-[[3-[4-[[[4-(4-hydroxyphenyl)butyl]amino]carbonyl]-2-oxazolyl]-7-oxabicyclo[2.2.1]hept-2-yl]methyl]benzenepropanoic acid 149117-78-2 C30H34N2O6