2-Fluorobenzoic acid → 2-Fluoro-N-propyl-N-(3,3,3-trifluoro-2-hydroxy-2-{[(1-phenyl-1H-indazol-4-yl)amino]methyl}propyl)benzamide

反応式

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

参加物

反応物 2

HCID 99352-Fluorobenzoic acid

HCID 593241711,1,1-Trifluoro-3-[(1-phenyl-1H-indazol-4-yl)amino]-2-[(propylamino)methyl]-2-propanol

生成物 1

HCID 593241282-Fluoro-N-propyl-N-(3,3,3-trifluoro-2-hydroxy-2-{[(1-phenyl-1H-indazol-4-yl)amino]methyl}propyl)benzamide

出典と根拠

ORDレコード: ord-cbbc197569cb44e79aa5bea3dddb2760
出典データセット: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

反応ノート

読み込み中…