1-(6-Methoxypyridin-2-yl)piperazine → 9-{4-[4-(6-methoxy-pyridin-2-yl)-piperazin-1-yl]-butyl}-9H-xanthene-9-carboxylic acid-(2,2,2-trifluoroethyl)-amide

HRID 699443

반응식

HRID 699443 반응식
[CH3:1][O:2][c:3]1[cH:4][cH:5][cH:6][c:7]([N:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[n:8]1.[F:15][C:16]([CH2:17][NH:18][C:19](=[O:20])[C:21]1([CH2:35][CH2:36][CH2:37][CH2:38][Br:39])[c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]2[O:28][c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]21)([F:40])[F:41]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][cH:6][c:7]([N:9]2[CH2:10][CH2:11][N:12]([CH2:38][CH2:37][CH2:36][CH2:35][C:21]3([C:19]([NH:18][CH2:17][C:16]([F:15])([F:40])[F:41])=[O:20])[c:22]4[cH:23][cH:24][cH:25][cH:26][c:27]4[O:28][c:29]4[cH:30][cH:31][cH:32][cH:33][c:34]43)[CH2:13][CH2:14]2)[n:8]1

참가 물질

3

반응물 2

HCID 122004701-(6-Methoxypyridin-2-yl)piperazineHCID 221802034-[9-(2,2,2-Trifluoroethylcarbamoyl)-9H-xanthen-9-yl]butyl bromide

생성물 1

HCID 226401519-{4-[4-(6-methoxy-pyridin-2-yl)-piperazin-1-yl]-butyl}-9H-xanthene-9-carboxylic acid-(2,2,2-trifluoroethyl)-amide

출처 및 근거

ORD 기록
ord-977fc52d23f5441c87e08b6178e630ad
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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