Ethanol → Potassium Cation

HRID 1543126Notes

Reaction equation

HRID 1543126 reaction equation
[CH3:43][CH2:44][OH:45].[K+:42].[OH-:41].[OH:1][CH2:2][CH2:3][n:4]1[n:5][c:6]([C:36](=[O:37])[O:38][CH2:39][CH3:40])[c:7]2[c:16]1-[c:15]1[c:10]([cH:11][n:12][c:13]([NH:17][c:18]3[c:19]([O:31][C:32]([F:33])([F:34])[F:35])[cH:20][cH:21][c:22]([N:24]4[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]4)[cH:23]3)[n:14]1)[CH2:9][CH2:8]2>>[K+:42].[OH:1][CH2:2][CH2:3][n:4]1[n:5][c:6]([C:36](=[O:37])[O-:38])[c:7]2[c:16]1-[c:15]1[c:10]([cH:11][n:12][c:13]([NH:17][c:18]3[c:19]([O:31][C:32]([F:33])([F:34])[F:35])[cH:20][cH:21][c:22]([N:24]4[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]4)[cH:23]3)[n:14]1)[CH2:9][CH2:8]2

Participants

6

Reactant 4

HCID 702EthanolHCID 813Potassium CationHCID 961HydroxideHCID 59454315HCID 59454315, compound

Product 2

HCID 813Potassium CationHCID 594543651-(2-Hydroxyethyl)-8-[5-(4-methylpiperazin-1-yl)-2-(trifluoromethoxy)anilino]-4,5-dihydropyrazolo[4,5-h]quinazoline-3-carboxylate

Sources & evidence

ORD record
ord-12e35209c88a4e9eb0ecfab60e3d3337
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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