4-(2,4-Dichlorophenyl)piperidine → 4-Chloro-7-[2-[4-(2,4-dichlorophenyl)piperidin-1-yl]-2-oxoethyl]-9-(2,2-dimethylpropyl)-3,6,7,10-tetrahydropyrazolo[3,4-i][2]benzazepin-8-one

HRID 1114493Notes

Reaction equation

HRID 1114493 reaction equation
[Cl:15][c:16]1[cH:17][c:18]2[c:19]([c:20]3[cH:21][n:22][nH:23][c:24]13)[CH2:25][N:26]([CH2:51][C:52]([CH3:53])([CH3:54])[CH3:55])[C:27](=[O:50])[CH:28]([CH2:30][C:31]([N:32]1[CH2:33][CH2:34][CH:35]([N:36]3[CH2:37][c:38]4[c:39]([cH:40][cH:41][cH:42][cH:43]4)[NH:44][C:45]3=[O:46])[CH2:47][CH2:48]1)=[O:49])[CH2:29]2.[Cl:1][c:2]1[c:3]([CH:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1>>[Cl:1][c:2]1[c:3]([CH:9]2[CH2:10][CH2:11][N:12]([C:31]([CH2:30][CH:28]3[C:27](=[O:50])[N:26]([CH2:51][C:52]([CH3:53])([CH3:54])[CH3:55])[CH2:25][c:19]4[c:18]([cH:17][c:16]([Cl:15])[c:24]5[c:20]4[cH:21][n:22][nH:23]5)[CH2:29]3)=[O:49])[CH2:13][CH2:14]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1

Participants

3

Reactant 2

HCID 166793154-(2,4-Dichlorophenyl)piperidineHCID 688264784-Chloro-9-(2,2-dimethylpropyl)-7-[2-oxo-2-[4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]ethyl]-3,6,7,10-tetrahydropyrazolo[3,4-i][2]benzazepin-8-one

Product 1

HCID 688270814-Chloro-7-[2-[4-(2,4-dichlorophenyl)piperidin-1-yl]-2-oxoethyl]-9-(2,2-dimethylpropyl)-3,6,7,10-tetrahydropyrazolo[3,4-i][2]benzazepin-8-one

Sources & evidence

ORD record
ord-95d7a970bd7c45f196d28e5d8dac71d4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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