Tetrahydrofuran → N-(2,3-dihydroxy-propoxy)-3,4-difluoro-2-(2-fluoro-phenylamino)-benzamide

반응식

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

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 8471Triethylamine

HCID 10206158N-(2,3-dihydroxypropoxy)-3,4-difluoro-2-(2-fluoro-4-iodoanilino)benzamide

생성물 1

HCID 10269634N-(2,3-dihydroxy-propoxy)-3,4-difluoro-2-(2-fluoro-phenylamino)-benzamide

출처 및 근거

ORD 기록: ord-07975cdd650e4bba90521ef6b6075b8a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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