Acetic Acid → HCID 13850707, compound

HRID 94112Notes

Reaction equation

HRID 94112 reaction equation
[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[CH3:48][C:49](=[O:50])[OH:51].[F:1][c:2]1[cH:3][c:4]2[c:5](=[O:24])[c:6]([C:21](=[O:22])[OH:23])[c:7]3[n:8]([c:9]2[cH:10][c:11]1[N:12]1[CH2:13][CH2:14][NH:15][CH2:16][CH2:17]1)[cH:18][cH:19][s:20]3.[O:25]=[C:26]1[O:27][C:28](=[O:29])[c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]21.[O:36]=[CH:37][N:38]([CH3:39])[CH3:40].[OH2:52]>>[F:1][c:2]1[cH:3][c:4]2[c:5](=[O:24])[c:6]([C:21](=[O:22])[OH:23])[c:7]3[n:8]([c:9]2[cH:10][c:11]1[N:12]1[CH2:13][CH2:14][N:15]([C:28](=[O:29])[c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]2[C:26](=[O:25])[OH:27])[CH2:16][CH2:17]1)[cH:18][cH:19][s:20]3

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 962WaterHCID 6228DimethylformamideHCID 6811Phthalic AnhydrideHCID 8471TriethylamineHCID 30691305H-Thiazolo(3,2-a)quinoline-4-carboxylic acid, 7-fluoro-5-oxo-8-(1-piperazinyl)-

Product 1

HCID 13850707HCID 13850707, compound

Sources & evidence

ORD record
ord-110d18d5453e46cfa85ec74a56e0ec74
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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