Benzoic Acid → HCID 59324158, 화합물

반응식

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

참가 물질

반응물 2

HCID 243Benzoic Acid

HCID 593241651,1,1-Trifluoro-3-{[1-(4-fluorophenyl)-6-methyl-1H-indazol-4-yl]amino}-2-[(propylamino)methyl]-2-propanol

생성물 1

HCID 59324158HCID 59324158, 화합물

출처 및 근거

ORD 기록: ord-4d768418daac46b6a635d5c3eb58d9fd
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…