Sodium ion → 4-(4-methyl-1H-pyrazol-1-yl)-N-(4-(3-(2-(methylamino)pyrimidin-4-yl)pyridin-2-yloxy)phenyl)phthalazin-1-amine

HRID 166309Notes

Reaction equation

HRID 166309 reaction equation
[CH2:7]1[O:8][CH2:9][CH2:10][CH2:11]1.[CH3:1][c:2]1[cH:3][n:4][nH:5][cH:6]1.[Cl:14][c:15]1[n:16][n:17][c:18]([NH:25][c:26]2[cH:27][cH:28][c:29]([O:32][c:33]3[n:34][cH:35][cH:36][cH:37][c:38]3-[c:39]3[n:40][c:41]([NH:45][CH3:46])[n:42][cH:43][cH:44]3)[cH:30][cH:31]2)[c:19]2[cH:20][cH:21][cH:22][cH:23][c:24]12.[H-:12].[Na+:13].[OH2:47]>>[CH3:1][c:2]1[cH:3][n:4][n:5](-[c:15]2[n:16][n:17][c:18]([NH:25][c:26]3[cH:27][cH:28][c:29]([O:32][c:33]4[n:34][cH:35][cH:36][cH:37][c:38]4-[c:39]4[n:40][c:41]([NH:45][CH3:46])[n:42][cH:43][cH:44]4)[cH:30][cH:31]3)[c:19]3[cH:20][cH:21][cH:22][cH:23][c:24]23)[cH:6]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 34064-MethylpyrazoleHCID 8028TetrahydrofuranHCID 166653HydrideHCID 42604330HCID 42604330, compound

Product 1

HCID 577562644-(4-methyl-1H-pyrazol-1-yl)-N-(4-(3-(2-(methylamino)pyrimidin-4-yl)pyridin-2-yloxy)phenyl)phthalazin-1-amine

Sources & evidence

ORD record
ord-31f6033a92d44677a961170eeaff6733
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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