Ethanol → HCID 14700567, compound

HRID 1149384Notes

Reaction equation

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

Participants

Reactant 4

HCID 702Ethanol

HCID 1049Pyridine

HCID 660572-Methylpiperazine

HCID 147005558-Chloro-1-ethyl-7-fluoro-4-oxo-1,4-dihydrobenzo[b][1,8]naphthyridine-3-carboxylic acid

Product 1

HCID 14700567HCID 14700567, compound

Sources & evidence

ORD record: ord-3c31efe0688846579b517baee8a5bc21
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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