Pyridine → 3-(1-Benzylpiperidin-4-yl)-8-fluoro-3,4-dihydroquinazolin-2(1H)-one

반응식

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][CH:11]([NH:14][CH2:15][c:16]2[c:17]([NH:23][C:24]([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30])[c:18]([F:22])[cH:19][cH:20][cH:21]2)[CH2:12][CH2:13]1.[cH:31]1[cH:32][cH:33][n:34][cH:35][cH:36]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][CH:11]([N:14]2[CH2:15][c:16]3[c:17]([c:18]([F:22])[cH:19][cH:20][cH:21]3)[NH:23][C:24]2=[O:30])[CH2:12][CH2:13]1

참가 물질

반응물 2

HCID 1049Pyridine

HCID 59424374tert-Butyl 2-((1-benzylpiperidin-4-ylamino)methyl)-6-fluorophenylcarbamate

생성물 1

HCID 211021543-(1-Benzylpiperidin-4-yl)-8-fluoro-3,4-dihydroquinazolin-2(1H)-one

출처 및 근거

ORD 기록: ord-405facd88e68439da9f09f495db4a27a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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