2-Fluoro-3-methoxyphenylboronic acid → 1-(2',6-Difluoro-3'-methoxybiphenyl-3-yl)-1-(3-fluoropyridin-4-yl)-1H-isoindol-3-amine

반응식

[Br:1][c:2]1[cH:3][c:4]([C:9]2([c:19]3[c:20]([F:25])[cH:21][n:22][cH:23][cH:24]3)[N:10]=[C:11]([NH2:18])[c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]32)[cH:5][cH:6][c:7]1[F:8].[F:26][c:27]1[c:28]([B:35]([OH:36])[OH:37])[cH:29][cH:30][cH:31][c:32]1[O:33][CH3:34]>>[c:2]1(-[c:28]2[c:27]([F:26])[c:32]([O:33][CH3:34])[cH:31][cH:30][cH:29]2)[cH:3][c:4]([C:9]2([c:19]3[c:20]([F:25])[cH:21][n:22][cH:23][cH:24]3)[N:10]=[C:11]([NH2:18])[c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]32)[cH:5][cH:6][c:7]1[F:8]

참가 물질

반응물 2

HCID 49857442-Fluoro-3-methoxyphenylboronic acid

HCID 59596245HCID 59596245, 화합물

생성물 1

HCID 248746971-(2',6-Difluoro-3'-methoxybiphenyl-3-yl)-1-(3-fluoropyridin-4-yl)-1H-isoindol-3-amine

출처 및 근거

ORD 기록: ord-b63f38eab1074bf0ba7e2e3edbf008d8
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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