1,1-Dichloroethane → 7-{4-[4-(1,3-Dihydro-isobenzofuran-4-yl)-piperazin-1-yl]-butoxy}-3,4-dihydro-1H-[1,8]naphthyridin-2-one

HRID 188272

Reaction equation

HRID 188272 reaction equation
[CH2:18]1[O:19][CH2:20][c:21]2[c:22]([N:27]3[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]3)[cH:23][cH:24][cH:25][c:26]21.[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[Cl:33][CH:34]([Cl:35])[CH3:36].[O:1]=[C:2]1[CH2:3][CH2:4][c:5]2[cH:6][cH:7][c:8]([O:12][CH2:13][CH2:14][CH2:15][CH:16]=[O:17])[n:9][c:10]2[NH:11]1>>[O:1]=[C:2]1[CH2:3][CH2:4][c:5]2[cH:6][cH:7][c:8]([O:12][CH2:13][CH2:14][CH2:15][CH2:16][N:30]3[CH2:29][CH2:28][N:27]([c:22]4[c:21]5[c:26]([cH:25][cH:24][cH:23]4)[CH2:18][O:19][CH2:20]5)[CH2:32][CH2:31]3)[n:9][c:10]2[NH:11]1

Participants

5

Reactant 4

HCID 63651,1-DichloroethaneHCID 8857Ethyl AcetateHCID 21073116HCID 21073116, compoundHCID 210733774-((7-Oxo-5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)oxy)butanal

Product 1

HCID 210734857-{4-[4-(1,3-Dihydro-isobenzofuran-4-yl)-piperazin-1-yl]-butoxy}-3,4-dihydro-1H-[1,8]naphthyridin-2-one

Sources & evidence

ORD record
ord-255d3478493a409eb4b667e6952319b2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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