Bicarbonate Ion → N-[4-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-a]pyridin-6-yl}oxy)-3-fluorophenyl]-5-methyl-6-phenylpyridine-2-carboxamide 1-oxide

HRID 211339Notes

Reaction equation

HRID 211339 reaction equation
[C:75](=[O:76])([O-:77])[OH:78].[CH3:25][c:26]1[cH:27][cH:28][c:29]([C:39](=[O:40])[OH:41])[n+:30]([O-:38])[c:31]1-[c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[CH3:80][N:81]([CH3:82])[CH:83]=[O:84].[CH3:85][CH2:86][O:87][C:88](=[O:89])[CH3:90].[CH:66]([N:67]([CH2:68][CH3:69])[CH:70]([CH3:71])[CH3:72])([CH3:73])[CH3:74].[NH2:1][c:2]1[cH:3][c:4]([F:24])[c:5]([O:6][c:7]2[cH:8][cH:9][c:10]3[n:11]([cH:12]2)[cH:13][c:14]([NH:16][C:17](=[O:18])[CH:19]2[CH2:20][CH2:21]2)[n:15]3)[cH:22][cH:23]1.[Na+:79].[P-:42]([F:43])([F:44])([F:45])([F:46])([F:47])[F:48].[n:49]1([O:50][C:51]([N:52]([CH3:53])[CH3:54])=[N+:55]([CH3:56])[CH3:57])[c:58]2[n:59][cH:60][cH:61][cH:62][c:63]2[n:64][n:65]1>>[NH:1]([c:2]1[cH:3][c:4]([F:24])[c:5]([O:6][c:7]2[cH:8][cH:9][c:10]3[n:11]([cH:12]2)[cH:13][c:14]([NH:16][C:17](=[O:18])[CH:19]2[CH2:20][CH2:21]2)[n:15]3)[cH:22][cH:23]1)[C:39]([c:29]1[cH:28][cH:27][c:26]([CH3:25])[c:31](-[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[n+:30]1[O-:38])=[O:40]

Participants

10

Reactant 9

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 581584865-Methyl-6-phenylpyridine-2-carboxylic acid 1-oxideHCID 58158605N-[6-(4-amino-2-fluorophenoxy)imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide

Product 1

HCID 58158607N-[4-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-a]pyridin-6-yl}oxy)-3-fluorophenyl]-5-methyl-6-phenylpyridine-2-carboxamide 1-oxide

Sources & evidence

ORD record
ord-a20c9387969547369f978e077f97ccfe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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