Hydrochloric Acid → HCID 44622554, compound

HRID 2155244Notes

Reaction equation

HRID 2155244 reaction equation
[CH3:56][N:57]1[CH2:58][CH2:59][CH2:60][C:61]1=[O:62].[CH:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH2:45][CH3:46])([CH3:47])[CH3:48].[Cl:1][c:2]1[n:3][c:4]([NH:19][C:20]2([C:23]([F:24])([F:25])[F:26])[CH2:21][CH2:22]2)[c:5]2[c:6]([n:7]1)[cH:8][cH:9][c:10](-[c:12]1[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]1)[n:11]2.[ClH:27].[F:49][C:50]([F:51])([F:52])[C:53]([OH:54])=[O:55].[NH2:28][CH2:29][c:30]1[cH:31][cH:32][c:33]([S:36](=[O:37])(=[O:38])[NH2:39])[cH:34][cH:35]1>>[c:2]1([NH:28][CH2:29][c:30]2[cH:31][cH:32][c:33]([S:36](=[O:37])(=[O:38])[NH2:39])[cH:34][cH:35]2)[n:3][c:4]([NH:19][C:20]2([C:23]([F:24])([F:25])[F:26])[CH2:21][CH2:22]2)[c:5]2[c:6]([n:7]1)[cH:8][cH:9][c:10](-[c:12]1[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]1)[n:11]2

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 3998MafenideHCID 6422Trifluoroacetic acidHCID 13387N-methyl-2-pyrrolidoneHCID 81531DiisopropylethylamineHCID 58275477[2-Chloro-6-(4-fluoro-phenyl)-pyrido[3,2-d]pyrimidin-4-yl]-(1-trifluoromethyl-cyclopropyl)-amine

Product 1

HCID 44622554HCID 44622554, compound

Sources & evidence

ORD record
ord-f5ec9a2a35494af19e823bfd303b27a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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