Water → 2-aminopyrido[2,3-d]pyrimidin-7(8H)-one 33

HRID 1219319Notes

Reaction equation

HRID 1219319 reaction equation
[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[c:12]([n:13][c:14]([S:17][CH3:18])[n:15][cH:16]3)[n:19]([CH3:22])[c:20]2=[O:21])[c:4]([Cl:8])[cH:5][cH:6][cH:7]1.[NH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][N:29]1[CH2:30][CH2:31][N:32]([CH3:35])[CH2:33][CH2:34]1.[OH2:36]>>[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[c:12]([n:13][c:14]([NH:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][N:29]4[CH2:30][CH2:31][N:32]([CH3:35])[CH2:33][CH2:34]4)[n:15][cH:16]3)[n:19]([CH3:22])[c:20]2=[O:21])[c:4]([Cl:8])[cH:5][cH:6][cH:7]1

Participants

4

Reactant 3

HCID 962WaterHCID 71384635-(4-Methylpiperazin-1-yl)pentan-1-amineHCID 107367016-(2,6-Dichlorophenyl)-8-methyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one

Product 1

HCID 53278802-aminopyrido[2,3-d]pyrimidin-7(8H)-one 33

Sources & evidence

ORD record
ord-f498b50162e0471aa283bf9ec7198507
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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