Hydrochloric Acid → 5-(4-bromo-2-fluoroanilino)-N-(2-hydroxypropoxy)imidazo[1,5-a]pyrazine-6-carboxamide

HRID 207960Notes

Reaction equation

HRID 207960 reaction equation
[Br:1][c:2]1[cH:3][c:4]([F:21])[c:5]([NH:8][c:9]2[c:10]([C:18](=[O:19])[OH:20])[n:11][cH:12][c:13]3[n:14]2[cH:15][n:16][cH:17]3)[cH:6][cH:7]1.[CH3:39][CH2:40][N:41]=[C:42]=[N:43][CH2:44][CH2:45][CH2:46][N:47]([CH3:48])[CH3:49].[CH3:50][N:51]1[CH2:52][CH2:53][O:54][CH2:55][CH2:56]1.[CH3:62][CH2:63][O:64][C:65](=[O:66])[CH3:67].[ClH:22].[NH2:23][O:24][CH2:25][CH:26]([CH3:27])[OH:28].[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[OH:29][n:30]1[c:31]2[c:32]([cH:33][cH:34][cH:35][cH:36]2)[n:37][n:38]1>>[Br:1][c:2]1[cH:3][c:4]([F:21])[c:5]([NH:8][c:9]2[c:10]([C:18](=[O:20])[NH:23][O:24][CH2:25][CH:26]([CH3:27])[OH:28])[n:11][cH:12][c:13]3[n:14]2[cH:15][n:16][cH:17]3)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 79724-MethylmorpholineHCID 8857Ethyl AcetateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 198387811-(Aminooxy)propan-2-olHCID 591401205-(4-Bromo-2-fluorophenylamino)imidazo[1,5-a]pyrazine-6-carboxylic acid

Product 1

HCID 749312015-(4-bromo-2-fluoroanilino)-N-(2-hydroxypropoxy)imidazo[1,5-a]pyrazine-6-carboxamide

Sources & evidence

ORD record
ord-77d7c565f3bf4907a1365c3def383b1b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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