4-Fluorobenzaldehyde → 4-Amino-5-chloro-N-((1-(5-(4-fluorobenzylamino)pentyl)piperidin-4-yl)methyl)-2-methoxybenzamide

반응식

[F:27][c:28]1[cH:29][cH:30][c:31]([CH:32]=[O:33])[cH:34][cH:35]1.[NH2:1][c:2]1[cH:3][c:4]([O:25][CH3:26])[c:5]([C:6](=[O:7])[NH:8][CH2:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][NH2:21])[CH2:14][CH2:15]2)[cH:22][c:23]1[Cl:24]>>[NH2:1][c:2]1[cH:3][c:4]([O:25][CH3:26])[c:5]([C:6](=[O:7])[NH:8][CH2:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][NH:21][CH2:32][c:31]3[cH:30][cH:29][c:28]([F:27])[cH:35][cH:34]3)[CH2:14][CH2:15]2)[cH:22][c:23]1[Cl:24]

참가 물질

반응물 2

HCID 680234-Fluorobenzaldehyde

HCID 540083634-Amino-N-(1-(5-aminopentyl)piperidin-4-ylmethyl)-5-chloro-2-methoxybenzamide

생성물 1

HCID 541377654-Amino-5-chloro-N-((1-(5-(4-fluorobenzylamino)pentyl)piperidin-4-yl)methyl)-2-methoxybenzamide

출처 및 근거

ORD 기록: ord-6c41df68a0c940d28f57cf5bf62b913b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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