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Bicarbonate Ion → 4-(2-hydroxypropan-2-yl)-N-(7-(thiophen-3-yl)pyrazolo[1,5-a]pyrimidin-5-yl)benzamide

HRID 174085
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HRID 174085 반응식
[CH3:37][OH:38].[Cl:1][c:2]1[cH:3][c:4]([NH:11][C:12]([c:13]2[cH:14][cH:15][c:16]([C:19]([CH3:20])([CH3:21])[OH:22])[cH:17][cH:18]2)=[O:23])[n:5][c:6]2[n:7]1[n:8][cH:9][cH:10]2.[Na+:36].[O-:32][C:33]([OH:34])=[O:35].[s:24]1[cH:25][c:26]([B:29]([OH:30])[OH:31])[cH:27][cH:28]1>>[c:2]1(-[c:26]2[cH:25][s:24][cH:28][cH:27]2)[cH:3][c:4]([NH:11][C:12]([c:13]2[cH:14][cH:15][c:16]([C:19]([CH3:20])([CH3:21])[OH:22])[cH:17][cH:18]2)=[O:23])[n:5][c:6]2[n:7]1[n:8][cH:9][cH:10]2
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참가 물질

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반응물 5

HCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium IonHCID 581760Thiophene-3-boronic acidHCID 86652272N-(7-chloropyrazolo[1,5-a]pyrimidin-5-yl)-4-(2-hydroxypropan-2-yl)benzamide

생성물 1

HCID 670642104-(2-hydroxypropan-2-yl)-N-(7-(thiophen-3-yl)pyrazolo[1,5-a]pyrimidin-5-yl)benzamide

출처 및 근거

ORD 기록
ord-e55bb9770e904caa9a2f9fa03ab11519
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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