Bicarbonate Ion → N-[4-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-a]pyridin-6-yl}oxy)phenyl]-N'-phenylcyclopropane-1,1-dicarboxamide

HRID 290524Notes

Reaction equation

HRID 290524 reaction equation
[C:72](=[O:73])([O-:74])[OH:75].[CH3:77][N:78]([CH3:79])[C:80](=[O:81])[CH3:82].[CH:63]([N:64]([CH2:65][CH3:66])[CH:67]([CH3:68])[CH3:69])([CH3:70])[CH3:71].[NH2:1][c:2]1[cH:3][cH:4][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+:76].[P-:39]([F:40])([F:41])([F:42])([F:43])([F:44])[F:45].[c:24]1([NH:30][C:31](=[O:32])[C:33]2([C:36](=[O:37])[OH:38])[CH2:34][CH2:35]2)[cH:25][cH:26][cH:27][cH:28][cH:29]1.[n:46]1([O:47][C:48]([N:49]([CH3:50])[CH3:51])=[N+:52]([CH3:53])[CH3:54])[c:55]2[n:56][cH:57][cH:58][cH:59][c:60]2[n:61][n:62]1>>[NH:1]([c:2]1[cH:3][cH:4][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:36]([C:33]1([C:31]([NH:30][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)=[O:32])[CH2:34][CH2:35]1)=[O:37]

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 9886HexafluorophosphateHCID 31374DimethylacetamideHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 190968711-(Phenylcarbamoyl)cyclopropanecarboxylic acidHCID 58158625N-[6-(4-aminophenoxy)imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide

Product 1

HCID 58158573N-[4-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-a]pyridin-6-yl}oxy)phenyl]-N'-phenylcyclopropane-1,1-dicarboxamide

Sources & evidence

ORD record
ord-73276d0dcd3448be9e4baa89e2469d41
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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