HCID 18414093, 화합물 → 4-(6-Methoxy-3-methylquinolin-8-yl)piperazine

반응식

[CH2:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[N:27]1[CH2:28][CH2:29][N:30]([c:33]2[cH:34][c:35]([O:44][CH3:45])[cH:36][c:37]3[cH:38][c:39]([CH3:43])[cH:40][n:41][c:42]23)[CH2:31][CH2:32]1.[CH2:46]([N:47]1[CH2:48][CH2:49][N:50]([c:51]2[cH:52][c:53]([O:54][CH3:55])[cH:56][c:57]3[c:58]2[n:59][c:60]([CH3:61])[cH:62][cH:63]3)[CH2:64][CH2:65]1)[c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([c:7]([N:8]3[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]3)[cH:14]1)[n:15][c:16]([CH3:17])[cH:18][cH:19]2>>[NH:27]1[CH2:28][CH2:29][N:30]([c:33]2[cH:34][c:35]([O:44][CH3:45])[cH:36][c:37]3[cH:38][c:39]([CH3:43])[cH:40][n:41][c:42]23)[CH2:31][CH2:32]1

참가 물질

반응물 3

HCID 18414093HCID 18414093, 화합물

HCID 18414117HCID 18414117, 화합물

HCID 184141504-(6-Methoxy-2-methylquinolin-8-yl)piperazine

생성물 1

HCID 184140574-(6-Methoxy-3-methylquinolin-8-yl)piperazine

출처 및 근거

ORD 기록: ord-39840974652b4437acd3819f1b034c2a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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