Trifluoroacetic acid → HCID 49779680, compound

HRID 688688Notes

Reaction equation

[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[c:8]1(-[c:14]2[cH:15][c:16](-[c:20]3[n:21][c:22]4[cH:23][c:24]([O:53][CH3:54])[c:25]([O:43][CH2:44][CH2:45][N:46]5[CH2:47][CH2:48][N:49]([CH3:52])[CH2:50][CH2:51]5)[cH:26][c:27]4[c:28]([NH:30][c:31]4[cH:32][c:33]5[cH:34][n:35][n:36]([C:40]([O-:41])=[O:42])[c:37]5[cH:38][cH:39]4)[n:29]3)[cH:17][cH:18][cH:19]2)[cH:9][cH:10][cH:11][cH:12][cH:13]1>>[c:8]1(-[c:14]2[cH:15][c:16](-[c:20]3[n:21][c:22]4[cH:23][c:24]([O:53][CH3:54])[c:25]([O:43][CH2:44][CH2:45][N:46]5[CH2:47][CH2:48][N:49]([CH3:52])[CH2:50][CH2:51]5)[cH:26][c:27]4[c:28]([NH:30][c:31]4[cH:32][c:33]5[cH:34][n:35][nH:36][c:37]5[cH:38][cH:39]4)[n:29]3)[cH:17][cH:18][cH:19]2)[cH:9][cH:10][cH:11][cH:12][cH:13]1

Participants

Reactant 2

HCID 6422Trifluoroacetic acid

HCID 866424085-(2-[(3-phenyl)phenyl)-7-methoxy-6-(2-(4-methylpiperazin-1-yl)ethoxy)quinazolin-4-ylamino)-1H-indazole-1-carboxylate

Product 1

HCID 49779680HCID 49779680, compound

Sources & evidence

ORD record: ord-2058da0bb9c246f392096d0e8980f890
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…