Hydrochloric Acid → 6-[4-(4-phthalimidomethyl-piperidin-1-yl)-3-nitro-phenyl]-4,5-dihydro-5-methyl-3(2H)-pyridazinone

HRID 692478Notes

Reaction equation

HRID 692478 reaction equation
[C:20]1(=[O:37])[c:21]2[c:22]([cH:33][cH:34][cH:35][cH:36]2)[C:23](=[O:32])[N:24]1[CH2:25][CH:26]1[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[Cl:1][c:2]1[c:3]([N+:16](=[O:17])[O-:18])[cH:4][c:5]([C:8]2=[N:13][NH:12][C:11](=[O:14])[CH2:10][CH:9]2[CH3:15])[cH:6][cH:7]1.[ClH:19].[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1>>[c:2]1([N:29]2[CH2:28][CH2:27][CH:26]([CH2:25][N:24]3[C:20](=[O:37])[c:21]4[c:22]([cH:33][cH:34][cH:35][cH:36]4)[C:23]3=[O:32])[CH2:31][CH2:30]2)[c:3]([N+:16](=[O:17])[O-:18])[cH:4][c:5]([C:8]2=[N:13][NH:12][C:11](=[O:14])[CH2:10][CH:9]2[CH3:15])[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 8471TriethylamineHCID 312751,4-DioxaneHCID 27739472-(Piperidin-4-ylmethyl)isoindoline-1,3-dioneHCID 28744326-(4-chloro-3-nitrophenyl)-5-methyl-4,5-dihydropyridazin-3(2H)-one

Product 1

HCID 144594966-[4-(4-phthalimidomethyl-piperidin-1-yl)-3-nitro-phenyl]-4,5-dihydro-5-methyl-3(2H)-pyridazinone

Sources & evidence

ORD record
ord-7b6222bbe5074f7ea1cd931482771a2b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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