Potassium Cation → HCID 12109548, compound

HRID 185292Notes

Reaction equation

HRID 185292 reaction equation
[C:36](=[O:37])([O-:38])[O-:39].[Cl:27][c:28]1[cH:29][c:30]([CH2:31][Cl:32])[cH:33][cH:34][cH:35]1.[F:20][C:21]([F:22])([F:23])[C:24]([OH:25])=[O:26].[F:42][C:43]([F:44])([F:45])[C:46]([OH:47])=[O:48].[K+:40].[K+:41].[N:1]1([CH2:7][c:8]2[n:9][n:10][c:11]3[c:12]([n:13]2)[c:14]([NH2:19])[n:15][c:16]([NH2:18])[n:17]3)[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[O:49]=[CH:50][N:51]([CH3:52])[CH3:53]>>[N:1]1([CH2:7][c:8]2[n:9][n:10][c:11]3[c:12]([n:13]2)[c:14]([NH2:19])[n:15][c:16]([NH2:18])[n:17]3)[CH2:2][CH2:3][N:4]([CH2:31][c:30]2[cH:29][c:28]([Cl:27])[cH:35][cH:34][cH:33]2)[CH2:5][CH2:6]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 6422Trifluoroacetic acid2×HCID 12103m,alpha-DichlorotolueneHCID 19660Carbonate IonHCID 121095363-Piperazin-1-ylmethyl-pyrimido[5,4-e][1,2,4]triazine-5,7-diamine

Product 1

HCID 12109548HCID 12109548, compound

Sources & evidence

ORD record
ord-ce4d7d37d65f451d82a24b515bc9b9bb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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