3-Chloro-1H-indole-6-carboxylic acid → 4-{2-[(3-Chloro-1H-indole-6-carbonyl)amino]-2-(2-fluoro-phenyl)ethoxymethyl}piperidine-1-carboxylic acid tert-butyl ester

HRID 1120818

반응식

HRID 1120818 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH2:14][O:15][CH2:16][CH:17]([c:18]2[c:19]([F:24])[cH:20][cH:21][cH:22][cH:23]2)[NH2:25])[CH2:12][CH2:13]1.[Cl:26][c:27]1[cH:28][nH:29][c:30]2[cH:31][c:32]([C:36](=[O:37])[OH:38])[cH:33][cH:34][c:35]12>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH2:14][O:15][CH2:16][CH:17]([c:18]2[c:19]([F:24])[cH:20][cH:21][cH:22][cH:23]2)[NH:25][C:36]([c:32]2[cH:31][c:30]3[nH:29][cH:28][c:27]([Cl:26])[c:35]3[cH:34][cH:33]2)=[O:37])[CH2:12][CH2:13]1

참가 물질

3

반응물 2

HCID 155430423-Chloro-1H-indole-6-carboxylic acidHCID 693080934-[2-Amino-2-(2-fluorophenyl)-ethoxymethyl]piperidine-1-carboxylic acid tert-butyl ester

생성물 1

HCID 693107064-{2-[(3-Chloro-1H-indole-6-carbonyl)amino]-2-(2-fluoro-phenyl)ethoxymethyl}piperidine-1-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-6c47e0c257404fa7b708cb175911ba24
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

연결된 노트

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