Quipazine → 9-[4-(4-quinolin-2-yl-piperazin-1-yl)-butyl]-9H-fluorene-9-carboxylic Acid-(2,2,3,3,3-pentafluoro-propyl)-amide

반응식

[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)([C:25]([F:26])([F:27])[F:28])[F:29].[N:30]1([c:36]2[n:37][c:38]3[cH:39][cH:40][cH:41][cH:42][c:43]3[cH:44][cH:45]2)[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]1>>[F:1][C:2]([CH2:3][NH:4][C:5](=[O:6])[C:7]1([CH2:20][CH2:21][CH2:22][CH2:23][N:33]2[CH2:32][CH2:31][N:30]([c:36]3[n:37][c:38]4[cH:39][cH:40][cH:41][cH:42][c:43]4[cH:44][cH:45]3)[CH2:35][CH2:34]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)([C:25]([F:26])([F:27])[F:28])[F:29]

참가 물질

반응물 2

HCID 5011Quipazine

HCID 226362759-(4-bromo-butyl)-9H-fluorene-9-carboxylic acid-(2,2,3,3,3-pentafluoro-propyl)-amide

생성물 1

HCID 226361769-[4-(4-quinolin-2-yl-piperazin-1-yl)-butyl]-9H-fluorene-9-carboxylic Acid-(2,2,3,3,3-pentafluoro-propyl)-amide

출처 및 근거

ORD 기록: ord-d4d869c1cc1e48ef9dc1b8d4ca58a399
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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