Potassium Cation → 3-(4-Chloro-2-fluorobenzyl)-N-(1-(4-methoxybenzyl)-5-methyl-1H-pyrazol-3-yl)-2-methyl-8-(morpholinomethyl)imidazo[1,2-b]pyridazin-6-amine

HRID 663866Notes

Reaction equation

HRID 663866 reaction equation
[C:44](=[O:45])([O-:46])[O-:47].[CH2:92]1[O:93][CH2:94][CH2:95][O:96][CH2:97]1.[CH3:28][O:29][c:30]1[cH:31][cH:32][c:33]([CH2:34][n:35]2[n:36][c:37]([NH2:41])[cH:38][c:39]2[CH3:40])[cH:42][cH:43]1.[Cl:1][c:2]1[cH:3][c:4]([CH2:21][N:22]2[CH2:23][CH2:24][O:25][CH2:26][CH2:27]2)[c:5]2[n:6]([n:7]1)[c:8]([CH2:12][c:13]1[c:14]([F:20])[cH:15][c:16]([Cl:19])[cH:17][cH:18]1)[c:9]([CH3:11])[n:10]2.[K+:48].[K+:49].[OH2:98].[c:50]1([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[c:59]3[c:83]([cH:84][cH:85][cH:86]2)[C:80]([CH3:81])([CH3:82])[c:62]2[c:61]([c:66]([P:67]([c:68]4[cH:69][cH:70][cH:71][cH:72][cH:73]4)[c:74]4[cH:75][cH:76][cH:77][cH:78][cH:79]4)[cH:65][cH:64][cH:63]2)[O:60]3)[cH:87][cH:88][cH:89][cH:90][cH:91]1>>[c:2]1([NH:41][c:37]2[n:36][n:35]([CH2:34][c:33]3[cH:32][cH:31][c:30]([O:29][CH3:28])[cH:43][cH:42]3)[c:39]([CH3:40])[cH:38]2)[cH:3][c:4]([CH2:21][N:22]2[CH2:23][CH2:24][O:25][CH2:26][CH2:27]2)[c:5]2[n:6]([n:7]1)[c:8]([CH2:12][c:13]1[c:14]([F:20])[cH:15][c:16]([Cl:19])[cH:17][cH:18]1)[c:9]([CH3:11])[n:10]2

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 962WaterHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)HCID 674274551-(4-methoxybenzyl)-5-methyl-1H-pyrazol-3-amineHCID 715739154-[[6-Chloro-3-(4-chloro-2-fluorobenzyl)-2-methylimidazo[1,2-b]pyridazin-8-yl]methyl]morpholine

Product 1

HCID 674350193-(4-Chloro-2-fluorobenzyl)-N-(1-(4-methoxybenzyl)-5-methyl-1H-pyrazol-3-yl)-2-methyl-8-(morpholinomethyl)imidazo[1,2-b]pyridazin-6-amine

Sources & evidence

ORD record
ord-9ebf4745a90241b0b9d0b8130132c37d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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