Trifluoroacetic acid → HCID 178508383, compound

HRID 2343886Notes

Reaction equation

[NH2:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:22]3[cH:23][c:24]([NH:28][C:29](=[O:30])[NH:31][c:32]4[cH:33][cH:34][c:35]([C:38]([F:39])([F:40])[F:41])[cH:36][cH:37]4)[cH:25][cH:26][cH:27]3)[n:10][n:11]([CH2:13][c:14]3[cH:15][cH:16][c:17]([O:18][CH3:19])[cH:20][cH:21]3)[cH:12]2)[n:7]1.[OH:42][C:43]([C:44]([F:45])([F:46])[F:47])=[O:48]>>[NH2:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:22]3[cH:23][c:24]([NH:28][C:29](=[O:30])[NH:31][c:32]4[cH:33][cH:34][c:35]([C:38]([F:39])([F:40])[F:41])[cH:36][cH:37]4)[cH:25][cH:26][cH:27]3)[n:10][nH:11][cH:12]2)[n:7]1

Participants

Reactant 2

HCID 6422Trifluoroacetic acid

HCID 671848701-{3-[4-(2-aminopyrimidin-4-yl)-1-(4-methoxybenzyl)-1H-pyrazol-3-yl]phenyl}-3-[4-(trifluoromethyl)phenyl]urea

Product 1

HCID 178508383HCID 178508383, compound

Sources & evidence

ORD record: ord-1fc2b575c1df4ad895e961329f528810
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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