4-Bromo-2-nitrobenzoic acid → (4-Bromo-2-nitrophenyl)[4-(3,5-dimethylpyridin-2-yl)piperazin-1-yl]methanone

HRID 169430

반응식

HRID 169430 반응식
[Br:1][c:2]1[cH:3][c:4]([N+:11](=[O:12])[O-:13])[c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[CH3:14][c:15]1[c:16]([N:22]2[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]2)[n:17][cH:18][c:19]([CH3:21])[cH:20]1>>[Br:1][c:2]1[cH:3][c:4]([N+:11](=[O:12])[O-:13])[c:5]([C:6](=[O:8])[N:25]2[CH2:24][CH2:23][N:22]([c:16]3[c:15]([CH3:14])[cH:20][c:19]([CH3:21])[cH:18][n:17]3)[CH2:27][CH2:26]2)[cH:9][cH:10]1

참가 물질

3

반응물 2

HCID 37744674-Bromo-2-nitrobenzoic acidHCID 584844961-(3,5-Dimethylpyridin-2-yl)piperazine

생성물 1

HCID 58484547(4-Bromo-2-nitrophenyl)[4-(3,5-dimethylpyridin-2-yl)piperazin-1-yl]methanone

출처 및 근거

ORD 기록
ord-b49a9287dc1c4b68a24a20f9f4e70c20
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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