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Dimethylformamide → 2-[1-(4-(Ethoxycarbonyl)piperazin-1-yl)carbonyl-2-(2-(ethoxycarbonyl)methoxyphenyl)ethyl]aminocarbonyl-4-methoxyquinoline

HRID 94425
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HRID 94425 반응식
[Br:38][CH2:39][C:40](=[O:41])[O:42][CH2:43][CH3:44].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12](=[O:13])[CH:14]([CH2:15][c:16]2[c:17]([OH:22])[cH:18][cH:19][cH:20][cH:21]2)[NH:23][C:24](=[O:25])[c:26]2[n:27][c:28]3[cH:29][cH:30][cH:31][cH:32][c:33]3[c:34]([O:36][CH3:37])[cH:35]2)[CH2:10][CH2:11]1.[O:45]=[CH:46][N:47]([CH3:48])[CH3:49]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12](=[O:13])[CH:14]([CH2:15][c:16]2[c:17]([O:22][CH2:39][C:40](=[O:41])[O:42][CH2:43][CH3:44])[cH:18][cH:19][cH:20][cH:21]2)[NH:23][C:24](=[O:25])[c:26]2[n:27][c:28]3[cH:29][cH:30][cH:31][cH:32][c:33]3[c:34]([O:36][CH3:37])[cH:35]2)[CH2:10][CH2:11]1
참가 물질출처 및 근거반응 노트

참가 물질

4

반응물 3

HCID 6228DimethylformamideHCID 7748Ethyl bromoacetateHCID 101420702-[1-(4-(Ethoxycarbonyl)piperazin-1-yl)carbonyl-2-(2-hydroxyphenyl)ethyl]aminocarbonyl-4-methoxyquinoline

생성물 1

HCID 221848662-[1-(4-(Ethoxycarbonyl)piperazin-1-yl)carbonyl-2-(2-(ethoxycarbonyl)methoxyphenyl)ethyl]aminocarbonyl-4-methoxyquinoline

출처 및 근거

ORD 기록
ord-5669eca7194949acbe109f69eff4b2fb
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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