Dichloromethane → methyl 3-[[7-[(4-fluorophenyl)methyl]-9-hydroxy-5-methoxy-8-oxo-6H-pyrrolo[3,4-g]quinolin-6-yl]sulfanyl]propanoate

HRID 107513Notes

Reaction equation

HRID 107513 reaction equation
[CH3:34][O:35][C:36]([CH2:37][CH2:38][SH:39])=[O:40].[Cl:41][CH2:42][Cl:43].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[CH:8]([OH:24])[c:9]3[c:10]([O:22][CH3:23])[c:11]4[cH:12][cH:13][cH:14][n:15][c:16]4[c:17]([OH:21])[c:18]3[C:19]2=[O:20])[cH:25][cH:26]1.[F:27][C:28]([F:29])([F:30])[C:31]([OH:32])=[O:33]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[CH:8]([S:39][CH2:38][CH2:37][C:36]([O:35][CH3:34])=[O:40])[c:9]3[c:10]([O:22][CH3:23])[c:11]4[cH:12][cH:13][cH:14][n:15][c:16]4[c:17]([OH:21])[c:18]3[C:19]2=[O:20])[cH:25][cH:26]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 18050Methyl 3-mercaptopropionateHCID 103834717-[(4-fluorophenyl)methyl]-6,9-dihydroxy-5-methoxy-6H-pyrrolo[3,4-g]quinolin-8-one

Product 1

HCID 10479199methyl 3-[[7-[(4-fluorophenyl)methyl]-9-hydroxy-5-methoxy-8-oxo-6H-pyrrolo[3,4-g]quinolin-6-yl]sulfanyl]propanoate

Sources & evidence

ORD record
ord-7ab70c6f3c824afa913f9e4d3ca6ef56
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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