Potassium Cation → tert-butyl 4-((4-(4-amino-2-fluorophenoxy)-1-(4-methoxybenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)methyl)piperidine-1-carboxylate

HRID 296677

반응식

HRID 296677 반응식
[C:52](=[O:53])([O-:54])[O-:55].[CH2:1]=[C:2]1[CH2:3][CH2:4][N:5]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[CH2:6][CH2:7]1.[CH3:24][O:25][c:26]1[cH:27][cH:28][c:29]([CH2:30][n:31]2[n:32][c:33]([I:49])[c:34]3[c:35]2[n:36][cH:37][cH:38][c:39]3[O:40][c:41]2[c:42]([F:48])[cH:43][c:44]([NH2:47])[cH:45][cH:46]2)[cH:50][cH:51]1.[CH:15]12[CH2:16][CH2:17][CH2:18][CH:19]([BH:20]1)[CH2:21][CH2:22][CH2:23]2.[K+:56].[K+:57].[Na+:59].[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[OH-:58].[OH2:65]>>[CH2:1]([CH:2]1[CH2:3][CH2:4][N:5]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[CH2:6][CH2:7]1)[c:33]1[n:32][n:31]([CH2:30][c:29]2[cH:28][cH:27][c:26]([O:25][CH3:24])[cH:51][cH:50]2)[c:35]2[c:34]1[c:39]([O:40][c:41]1[c:42]([F:48])[cH:43][c:44]([NH2:47])[cH:45][cH:46]1)[cH:38][cH:37][n:36]2

참가 물질

10

반응물 9

HCID 813Potassium Cation2회HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 789669-Borabicyclo(3.3.1)nonaneHCID 27568081-Boc-4-MethylenepiperidineHCID 672210033-Fluoro-4-((3-iodo-1-(4-methoxybenzyl)-1H-pyrazolo[3,4-b]pyridin-4-yl)oxy)aniline

생성물 1

HCID 68517133tert-butyl 4-((4-(4-amino-2-fluorophenoxy)-1-(4-methoxybenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)methyl)piperidine-1-carboxylate

출처 및 근거

ORD 기록
ord-b38566c064d34b128a585e169cbb114c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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