1,2-Dichloroethane → (3-Ethynyl-4-fluoro-phenyl)-(6-methyl-pyrido[3,4-d]pyrimidin-4-yl)-amine

HRID 125845Notes

Reaction equation

HRID 125845 reaction equation
[C:32]([Cl:33])([Cl:34])([Cl:35])[Cl:36].[C:37](#[CH:38])[c:39]1[cH:40][c:41]([NH2:42])[cH:43][cH:44][c:45]1[F:46].[CH3:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7][nH:8][c:9]2=[O:10])[cH:11][n:12]1.[Cl:47][CH2:48][CH2:49][Cl:50].[c:13]1([P:14]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[CH3:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7][n:8][c:9]2[NH:42][c:41]2[cH:40][c:39]([C:37]#[CH:38])[c:45]([F:46])[cH:44][cH:43]2)[cH:11][n:12]1

Participants

6

Reactant 5

HCID 111,2-DichloroethaneHCID 5943Carbon TetrachlorideHCID 11776TriphenylphosphineHCID 126873623-Ethynyl-4-fluoroanilineHCID 1359920016Methyl-pyrido[3,4-d]pyrimid-4one

Product 1

HCID 22460819(3-Ethynyl-4-fluoro-phenyl)-(6-methyl-pyrido[3,4-d]pyrimidin-4-yl)-amine

Sources & evidence

ORD record
ord-51b8dadd75af47ccb7dc277e8189e377
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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