Potassium Cation → 1-[4-(3-tert-Butyl-2-oxoimidazolidin-1-yl)-2-fluorophenyl]-5-methoxy-3-(1-phenyl-1H-pyrazol-5-yl)pyridazin-4(1H)-one

HRID 2311956Notes

Reaction equation

HRID 2311956 reaction equation
[C:29]([CH3:30])([CH3:31])([CH3:32])[N:33]1[C:34](=[O:38])[NH:35][CH2:36][CH2:37]1.[CH3:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1.[Cu:62][I:63].[F:1][c:2]1[c:3](-[n:9]2[n:10][c:11](-[c:18]3[cH:19][cH:20][n:21][n:22]3-[c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[c:12](=[O:17])[c:13]([O:15][CH3:16])[cH:14]2)[cH:4][cH:5][c:6]([I:8])[cH:7]1.[K+:52].[K+:53].[K+:54].[NH2:39][CH:40]1[CH2:41][CH2:42][CH2:43][CH2:44][CH:45]1[NH2:46].[P:47]([O-:48])([O-:49])([O-:50])=[O:51]>>[F:1][c:2]1[c:3](-[n:9]2[n:10][c:11](-[c:18]3[cH:19][cH:20][n:21][n:22]3-[c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[c:12](=[O:17])[c:13]([O:15][CH3:16])[cH:14]2)[cH:4][cH:5][c:6]([N:35]2[C:34](=[O:38])[N:33]([C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:37][CH2:36]2)[cH:7]1

Participants

8

Reactant 7

HCID 813Potassium Cation3×HCID 1061PhosphateHCID 1140TolueneHCID 46101,2-DiaminocyclohexaneHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 27952311-Tert-butylimidazolidin-2-oneHCID 594362141-(2-fluoro-4-iodophenyl)-5-methoxy-3-(1-phenyl-1H-pyrazol-5-yl)pyridazin-4(1H)-one

Product 1

HCID 580723731-[4-(3-tert-Butyl-2-oxoimidazolidin-1-yl)-2-fluorophenyl]-5-methoxy-3-(1-phenyl-1H-pyrazol-5-yl)pyridazin-4(1H)-one

Sources & evidence

ORD record
ord-3752aef00e1941bcad443bdf1a57c881
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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