Dichloromethane → 2-piperazin-1-yl-1-[(4-pyridin-4-yl)phenyl]-1H-indole-3-carboxaldehyde

반응식

[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[n:15](-[c:25]3[cH:26][cH:27][c:28](-[c:31]4[cH:32][cH:33][n:34][cH:35][cH:36]4)[cH:29][cH:30]3)[c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]3[c:22]2[CH:23]=[O:24])[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[Cl:44][CH2:45][Cl:46].[OH:37][C:38]([C:39]([F:40])([F:41])[F:42])=[O:43]>>[NH:8]1[CH2:9][CH2:10][N:11]([c:14]2[n:15](-[c:25]3[cH:26][cH:27][c:28](-[c:31]4[cH:32][cH:33][n:34][cH:35][cH:36]4)[cH:29][cH:30]3)[c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]3[c:22]2[CH:23]=[O:24])[CH2:12][CH2:13]1

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 86596815HCID 86596815, 화합물

생성물 1

HCID 112690582-piperazin-1-yl-1-[(4-pyridin-4-yl)phenyl]-1H-indole-3-carboxaldehyde

출처 및 근거

ORD 기록: ord-53d51da176574aef895ea428c4fdaebe
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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