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Bicarbonate Ion → Benzyl [4-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-a]pyridin-6-yl}oxy)-2-fluorophenyl]carbamate

HRID 2314900
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HRID 2314900 반응식
[C:37](=[O:38])([O-:39])[OH:40].[CH3:42][N:43]([CH3:44])[C:45](=[O:46])[CH3:47].[CH:30]1([C:33](=[O:34])[Cl:35])[CH2:31][CH2:32]1.[NH2:1][c:2]1[n:3][c:4]2[n:5]([cH:6][c:7]([O:10][c:11]3[cH:12][c:13]([F:28])[c:14]([NH:17][C:18]([O:19][CH2:20][c:21]4[cH:22][cH:23][cH:24][cH:25][cH:26]4)=[O:27])[cH:15][cH:16]3)[cH:8][cH:9]2)[cH:29]1.[Na+:41].[OH2:36]>>[NH:1]([c:2]1[n:3][c:4]2[n:5]([cH:6][c:7]([O:10][c:11]3[cH:12][c:13]([F:28])[c:14]([NH:17][C:18]([O:19][CH2:20][c:21]4[cH:22][cH:23][cH:24][cH:25][cH:26]4)=[O:27])[cH:15][cH:16]3)[cH:8][cH:9]2)[cH:29]1)[C:33]([CH:30]1[CH2:31][CH2:32]1)=[O:34]
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7

반응물 6

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 31374DimethylacetamideHCID 77637Cyclopropanecarbonyl chlorideHCID 58158524Benzyl {4-[(2-aminoimidazo[1,2-a]pyridin-6-yl)oxy]-2-fluorophenyl}carbamate

생성물 1

HCID 58158453
Benzyl [4-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-a]pyridin-6-yl}oxy)-2-fluorophenyl]carbamate

출처 및 근거

ORD 기록
ord-76619a29aff84f368b645988d24ad80c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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