Dimethylformamide → 7-(4-Amino-2-isoindolinyl)-1-cyclopropyl-5-(2-hydroxyethylamino)-6,8-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

HRID 2143556Notes

Reaction equation

HRID 2143556 reaction equation
[CH2:35]1[CH2:36][CH2:37][C:38]2=[N:43][CH2:42][CH2:41][CH2:40][N:39]2[CH2:44][CH2:45]1.[CH:1]1([n:4]2[cH:5][c:6]([C:22](=[O:23])[OH:24])[c:7](=[O:21])[c:8]3[c:9]([NH:17][CH2:18][CH2:19][OH:20])[c:10]([F:16])[c:11]([F:15])[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1.[NH2:25][c:26]1[c:27]2[c:31]([cH:32][cH:33][cH:34]1)[CH2:30][NH:29][CH2:28]2.[O:46]=[CH:47][N:48]([CH3:49])[CH3:50]>>[CH:1]1([n:4]2[cH:5][c:6]([C:22](=[O:23])[OH:24])[c:7](=[O:21])[c:8]3[c:9]([NH:17][CH2:18][CH2:19][OH:20])[c:10]([F:16])[c:11]([N:29]4[CH2:28][c:27]5[c:26]([NH2:25])[cH:34][cH:33][cH:32][c:31]5[CH2:30]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1

Participants

5

Reactant 4

HCID 6228DimethylformamideHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 14795861Isoindolin-4-amineHCID 198284861-Cyclopropyl-5(2-hydroxyethylamino)-6,7,8-trifluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Product 1

HCID 147957897-(4-Amino-2-isoindolinyl)-1-cyclopropyl-5-(2-hydroxyethylamino)-6,8-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Sources & evidence

ORD record
ord-0d05c2c2618a4de7b6e2d2aaa2570a08
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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