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Hydrochloric Acid → Methyl 2-amino-6-{[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]amino}-pyrimidine-4-carboxylate

HRID 1563065
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HRID 1563065 반응식
[C:32](=[O:33])([OH:34])[O-:35].[CH3:38][CH2:39][OH:40].[ClH:31].[F:13][c:14]1[cH:15][c:16]([NH2:17])[cH:18][cH:19][c:20]1[O:21][c:22]1[c:23]2[c:24]([n:25][cH:26][cH:27]1)[nH:28][cH:29][cH:30]2.[NH2:1][c:2]1[n:3][c:4]([Cl:12])[cH:5][c:6]([C:8](=[O:9])[O:10][CH3:11])[n:7]1.[Na+:36].[OH2:37]>>[NH2:1][c:2]1[n:3][c:4]([NH:17][c:16]2[cH:15][c:14]([F:13])[c:20]([O:21][c:22]3[c:23]4[c:24]([n:25][cH:26][cH:27]3)[nH:28][cH:29][cH:30]4)[cH:19][cH:18]2)[cH:5][c:6]([C:8](=[O:9])[O:10][CH3:11])[n:7]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 239687Methyl 2-amino-6-chloropyrimidine-4-carboxylateHCID 160379654-((1H-Pyrrolo[2,3-B]pyridin-4-YL)oxy)-3-fluoroaniline

생성물 1

출처 및 근거

ORD 기록
ord-d5be9c99c71b449081748f655463d224
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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HCID 17979310
Methyl 2-amino-6-{[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]amino}-pyrimidine-4-carboxylate