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Hydrochloric Acid → N-[3-(3,4,5-trimethoxyphenyl)benzoyl]-N'-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]piperazine

HRID 160334
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HRID 160334 반응식
[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:13]2[n:14][cH:15][cH:16][c:17]([CH2:19][N:20]3[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]3)[cH:18]2)[cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10].[CH3:26][O:27][c:28]1[cH:29][c:30](-[c:38]2[cH:39][c:40]([C:41](=[O:42])[OH:43])[cH:44][cH:45][cH:46]2)[cH:31][c:32]([O:36][CH3:37])[c:33]1[O:34][CH3:35].[CH3:47][CH2:48][N:49]([CH2:50][CH3:51])[CH2:52][CH3:53].[CH3:58][N:59]([CH3:60])[c:61]1[cH:62][cH:63][n:64][cH:65][cH:66]1.[Cl:67][CH2:68][Cl:69].[ClH:54].[NH:55]=[C:56]=[NH:57]>>[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:13]2[n:14][cH:15][cH:16][c:17]([CH2:19][N:20]3[CH2:21][CH2:22][N:23]([C:41]([c:40]4[cH:39][c:38](-[c:30]5[cH:29][c:28]([O:27][CH3:26])[c:33]([O:34][CH3:35])[c:32]([O:36][CH3:37])[cH:31]5)[cH:46][cH:45][cH:44]4)=[O:42])[CH2:24][CH2:25]3)[cH:18]2)[cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 142844-(Dimethylamino)pyridineHCID 160435CarbodiimideHCID 120211551-[[2-(3,4,5-Trimethoxyphenyl)pyridin-4-yl]-methyl]piperazineHCID 225580663-(3,4,5-Trimethoxyphenyl)benzoic acid

생성물 1

HCID 18546841N-[3-(3,4,5-trimethoxyphenyl)benzoyl]-N'-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]piperazine

출처 및 근거

ORD 기록
ord-bca6225b09494aa0b2eb1d7dde98c830
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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