Hydrochloric Acid → N-{2-fluoro-5-[(2-{[(2,2,3,3-tetramethylcyclopropyl)carbonyl]amino}imidazo[1,2-b]pyridazin-6-yl)oxy]phenyl}-1,3-dimethyl-1H-pyrazole-5-carboxamide

HRID 299195

Reaction equation

HRID 299195 reaction equation
[CH3:11][N:12]([CH3:13])[CH:14]=[O:15].[CH3:1][C:2]1([CH3:3])[CH:4]([C:5]([OH:6])=[O:7])[C:8]1([CH3:9])[CH3:10].[CH3:61][N:62]([CH3:63])[C:64](=[O:65])[CH3:66].[Cl:16][C:17]([C:18]([Cl:19])=[O:20])=[O:21].[ClH:22].[NH2:23][c:24]1[n:25][c:26]2[n:27]([n:28][c:29]([O:32][c:33]3[cH:34][cH:35][c:36]([F:49])[c:37]([NH:39][C:40](=[O:41])[c:42]4[cH:43][c:44]([CH3:48])[n:45][n:46]4[CH3:47])[cH:38]3)[cH:30][cH:31]2)[cH:50]1.[Na+:51].[O:56]1[CH2:57][CH2:58][CH2:59][CH2:60]1.[OH:52][C:53](=[O:54])[O-:55]>>[CH3:1][C:2]1([CH3:3])[CH:4]([C:5](=[O:7])[NH:23][c:24]2[n:25][c:26]3[n:27]([n:28][c:29]([O:32][c:33]4[cH:34][cH:35][c:36]([F:49])[c:37]([NH:39][C:40](=[O:41])[c:42]5[cH:43][c:44]([CH3:48])[n:45][n:46]5[CH3:47])[cH:38]4)[cH:30][cH:31]3)[cH:50]2)[C:8]1([CH3:9])[CH3:10]

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 31374DimethylacetamideHCID 65578Oxalyl chlorideHCID 1521152,2,3,3-Tetramethylcyclopropanecarboxylic acidHCID 57505568N-[5-(2-aminoimidazo[1,2-b]pyridazin-6-yl)oxy-2-fluorophenyl]-2,5-dimethylpyrazole-3-carboxamide

Product 1

HCID 57505600N-{2-fluoro-5-[(2-{[(2,2,3,3-tetramethylcyclopropyl)carbonyl]amino}imidazo[1,2-b]pyridazin-6-yl)oxy]phenyl}-1,3-dimethyl-1H-pyrazole-5-carboxamide

Sources & evidence

ORD record
ord-9a5ccf4d034b4a03823aafbf064f28b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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