Hydrochloric Acid → Ethyl 3-[(3-oxo-6-pyridin-4-yl-2,3-dihydropyridazine-4-carbonyl)amino]propionate

HRID 101509

Reaction equation

HRID 101509 reaction equation
[CH2:12]([CH3:13])[O:14][C:15]([CH2:16][CH2:17][NH2:18])=[O:19].[CH3:69][N:70]([CH3:71])[CH:72]=[O:73].[CH:20]([N:21]([CH2:22][CH3:23])[CH:24]([CH3:25])[CH3:26])([CH3:27])[CH3:28].[ClH:11].[O:53]=[c:54]1[nH:55][n:56][c:57](-[c:63]2[cH:64][cH:65][n:66][cH:67][cH:68]2)[cH:58][c:59]1[C:60](=[O:61])[OH:62].[OH:1][n:2]1[c:3]2[cH:4][cH:5][cH:6][cH:7][c:8]2[n:9][n:10]1.[P-:29]([F:30])([F:31])([F:32])([F:33])([F:34])[F:35].[n:36]1([O:37][C:38]([N:39]([CH3:40])[CH3:41])=[N+:42]([CH3:43])[CH3:44])[c:45]2[n:46][cH:47][cH:48][cH:49][c:50]2[n:51][n:52]1>>[CH2:12]([CH3:13])[O:14][C:15]([CH2:16][CH2:17][NH:18][C:60]([c:59]1[c:54](=[O:53])[nH:55][n:56][c:57](-[c:63]2[cH:64][cH:65][n:66][cH:67][cH:68]2)[cH:58]1)=[O:61])=[O:19]

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 419889Ethyl 3-aminopropanoateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 127902383-Oxo-6-(pyridin-4-yl)-2,3-dihydropyridazine-4-carboxylic acid

Product 1

HCID 10313657Ethyl 3-[(3-oxo-6-pyridin-4-yl-2,3-dihydropyridazine-4-carbonyl)amino]propionate

Sources & evidence

ORD record
ord-7dc4918fcf8e4efda9cd4b4aede9cd94
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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