1-(2,4-Xylyl)piperazine → 1-(2,4-dimethylphenyl)-4-(3-(1-phenyl-5-propyl-1H-pyrazol-3-yl)propyl)piperazine

HRID 105242

반응식

HRID 105242 반응식
[CH3:19][c:20]1[c:21]([N:27]2[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]2)[cH:22][cH:23][c:24]([CH3:26])[cH:25]1.[CH:33]([N:34]([CH2:35][CH3:36])[CH:37]([CH3:38])[CH3:39])([CH3:40])[CH3:41].[c:1]1(-[n:7]2[n:8][c:9]([CH2:15][CH2:16][CH:17]=[O:18])[cH:10][c:11]2[CH2:12][CH2:13][CH3:14])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[n:7]2[n:8][c:9]([CH2:15][CH2:16][CH2:17][N:30]3[CH2:29][CH2:28][N:27]([c:21]4[c:20]([CH3:19])[cH:25][c:24]([CH3:26])[cH:23][cH:22]4)[CH2:32][CH2:31]3)[cH:10][c:11]2[CH2:12][CH2:13][CH3:14])[cH:2][cH:3][cH:4][cH:5][cH:6]1

참가 물질

4

반응물 3

HCID 705441-(2,4-Xylyl)piperazineHCID 81531DiisopropylethylamineHCID 866399313-(1-phenyl-5-propyl-1H-pyrazol-3-yl)propanal

생성물 1

HCID 685560031-(2,4-dimethylphenyl)-4-(3-(1-phenyl-5-propyl-1H-pyrazol-3-yl)propyl)piperazine

출처 및 근거

ORD 기록
ord-b3d329798b42495db3bde3d665b6efa1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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