3-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carbonyl chloride → 3-{4-[3-(Isobutyrylamino)phenyl]-1-piperidinyl}propyl 3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarboxylate

HRID 210031

반응식

HRID 210031 반응식
[Cl:23][c:24]1[c:25](-[c:31]2[n:32][o:33][c:34]([CH3:39])[c:35]2[C:36](=[O:37])[Cl:38])[c:26]([Cl:30])[cH:27][cH:28][cH:29]1.[OH:1][CH2:2][CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][CH:8]([c:11]2[cH:12][c:13]([NH:17][C:18]([CH:19]([CH3:20])[CH3:21])=[O:22])[cH:14][cH:15][cH:16]2)[CH2:9][CH2:10]1>>[O:1]([CH2:2][CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][CH:8]([c:11]2[cH:12][c:13]([NH:17][C:18]([CH:19]([CH3:20])[CH3:21])=[O:22])[cH:14][cH:15][cH:16]2)[CH2:9][CH2:10]1)[C:36]([c:35]1[c:31](-[c:25]2[c:24]([Cl:23])[cH:29][cH:28][cH:27][c:26]2[Cl:30])[n:32][o:33][c:34]1[CH3:39])=[O:37]

참가 물질

3

반응물 2

HCID 782123-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carbonyl chlorideHCID 22048877N-{3-[1-(3-Hydroxypropyl)-4-piperidinyl]phenyl}-2-methylpropanamide

생성물 1

HCID 220495763-{4-[3-(Isobutyrylamino)phenyl]-1-piperidinyl}propyl 3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarboxylate

출처 및 근거

ORD 기록
ord-21f7d21b8f294ba7bd24059b34fd6cf0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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