1-Aminocyclopentanemethanol → 3-Fluoro-N-{4-[(2-{[1-(hydroxymethyl)cyclopentyl]amino}pyrimidin-4-yl)oxy]-1-naphthyl}-5-piperidin-1-ylbenzamide

반응식

[F:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[cH:9][cH:10][c:11]([O:18][c:19]3[n:20][c:21]([S:25]([CH3:26])(=[O:27])=[O:28])[n:22][cH:23][cH:24]3)[c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]23)[cH:29][c:30]([N:32]2[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37]2)[cH:31]1.[NH2:38][C:39]1([CH2:44][OH:45])[CH2:40][CH2:41][CH2:42][CH2:43]1>>[F:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[cH:9][cH:10][c:11]([O:18][c:19]3[n:20][c:21]([NH:38][C:39]4([CH2:44][OH:45])[CH2:40][CH2:41][CH2:42][CH2:43]4)[n:22][cH:23][cH:24]3)[c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]23)[cH:29][c:30]([N:32]2[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37]2)[cH:31]1

참가 물질

반응물 2

HCID 663071-Aminocyclopentanemethanol

HCID 667379693-fluoro-N-[4-(2-methanesulfonyl-pyrimidin-4-yloxy)-naphthalen-1-yl]-5-piperidin-1-yl-benzamide

생성물 1

HCID 595533313-Fluoro-N-{4-[(2-{[1-(hydroxymethyl)cyclopentyl]amino}pyrimidin-4-yl)oxy]-1-naphthyl}-5-piperidin-1-ylbenzamide

출처 및 근거

ORD 기록: ord-1481d48125354ba69043ce4efe5675b5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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