4-Methyl-2-piperazin-1-yl-quinoline → 9-{4-[4-(4-methyl-quinolin-2-yl)-piperazin-1-yl]-butyl}-9H-fluorene-9-carboxylic Acid-(2,2,2-trifluoro-ethyl)-amide

반응식

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

참가 물질

반응물 2

HCID 5987544-Methyl-2-piperazin-1-yl-quinoline

HCID 105264379-(4-Bromobutyl)-N-(2,2,2-trifluoroethyl)-9H-fluorene-9-carboxamide

생성물 1

HCID 226361729-{4-[4-(4-methyl-quinolin-2-yl)-piperazin-1-yl]-butyl}-9H-fluorene-9-carboxylic Acid-(2,2,2-trifluoro-ethyl)-amide

출처 및 근거

ORD 기록: ord-3115d7f9e48a4a9b92314f7ca3bbd44f
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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