Hydrochloric Acid → 4-[4-(6-Fluoro-pyrido[3,4-d]pyrimidin-4-ylamino)-2-methyl-phenoxy]-piperidine-1-carboxylic acid (2,6-difluoro-phenyl)-amide

HRID 697848Notes

Reaction equation

HRID 697848 reaction equation
[Cl:39][CH2:40][Cl:41].[ClH:12].[F:13][c:14]1[cH:15][c:16]2[c:17]([n:18][cH:19][n:20][c:21]2[NH:22][c:23]2[cH:24][c:25]([CH3:36])[c:26]([O:29][CH:30]3[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]3)[cH:27][cH:28]2)[cH:37][n:38]1.[F:1][c:2]1[c:3]([N:9]=[C:10]=[O:11])[c:4]([F:8])[cH:5][cH:6][cH:7]1>>[F:1][c:2]1[c:3]([NH:9][C:10](=[O:11])[N:33]2[CH2:32][CH2:31][CH:30]([O:29][c:26]3[c:25]([CH3:36])[cH:24][c:23]([NH:22][c:21]4[c:16]5[cH:15][c:14]([F:13])[n:38][cH:37][c:17]5[n:18][cH:19][n:20]4)[cH:28][cH:27]3)[CH2:35][CH2:34]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 5221622,6-Difluorophenyl isocyanateHCID 69051976(6-Fluoro-pyrido[3,4-d]pyrimidin-4-yl)-[3-methyl-4-(piperidin-4-yloxy)-phenyl]-amine

Product 1

HCID 865952374-[4-(6-Fluoro-pyrido[3,4-d]pyrimidin-4-ylamino)-2-methyl-phenoxy]-piperidine-1-carboxylic acid (2,6-difluoro-phenyl)-amide

Sources & evidence

ORD record
ord-4a6d2b9d3de6446cb7e7c4440e803912
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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