Acetic Acid → HCID 4914114, compound

HRID 92607Notes

Reaction equation

HRID 92607 reaction equation
[C:39].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][c:9]1[c:10]2[c:11](=[O:34])[c:12]([C:31](=[O:32])[OH:33])[cH:13][n:14]([CH:28]3[CH2:29][CH2:30]3)[c:15]2[c:16]([F:27])[c:17]([N:20]2[CH2:21][CH2:22][N:23]([CH3:26])[CH2:24][CH2:25]2)[c:18]1[F:19].[CH3:35][C:36](=[O:37])[OH:38].[CH3:41][CH2:42][OH:43].[Pd:40]>>[NH2:8][c:9]1[c:10]2[c:11](=[O:34])[c:12]([C:31](=[O:32])[OH:33])[cH:13][n:14]([CH:28]3[CH2:29][CH2:30]3)[c:15]2[c:16]([F:27])[c:17]([N:20]2[CH2:21][CH2:22][N:23]([CH3:26])[CH2:24][CH2:25]2)[c:18]1[F:19]

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 297MethaneHCID 702EthanolHCID 23938PalladiumHCID 146641725-Benzylamino-1-cyclopropyl-6,8-difluoro-7-(4-methyl-1-piperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Product 1

HCID 4914114HCID 4914114, compound

Sources & evidence

ORD record
ord-7fff071ab5d24522b717c5ed69494e41
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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