(3-(5-Methyl-1,3,4-oxadiazol-2-yl)phenyl)boronic acid → (1-Methyl-cyclohexyl)-{2-[3-(5-methyl-[1,3,4]oxadiazol-2-yl)-phenyl]-5H-pyrrolo[2,3-b]pyrazin-7-yl}-methanone

반응식

[Br:1][c:2]1[n:3][c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2[C:11](=[O:12])[C:13]1([CH3:19])[CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]1.[CH3:20][c:21]1[n:22][n:23][c:24](-[c:26]2[cH:27][c:28]([B:32]([OH:33])[OH:34])[cH:29][cH:30][cH:31]2)[o:25]1>>[c:2]1(-[c:28]2[cH:27][c:26](-[c:24]3[n:23][n:22][c:21]([CH3:20])[o:25]3)[cH:31][cH:30][cH:29]2)[n:3][c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2[C:11](=[O:12])[C:13]1([CH3:19])[CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]1

참가 물질

반응물 2

HCID 44119380(3-(5-Methyl-1,3,4-oxadiazol-2-yl)phenyl)boronic acid

HCID 44199730(2-bromo-5H-pyrrolo[2,3-b]pyrazin-7-yl)-(1-methyl-cyclohexyl)-methanone

생성물 1

HCID 59540696(1-Methyl-cyclohexyl)-{2-[3-(5-methyl-[1,3,4]oxadiazol-2-yl)-phenyl]-5H-pyrrolo[2,3-b]pyrazin-7-yl}-methanone

출처 및 근거

ORD 기록: ord-c706403626d942bbae9cb31f5fedc13b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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