Dichloromethane → 8-[1-(3,5-Difluoroanilino)ethyl]-6-(3-hydroxypyrrolidine-1-carbonyl)-2-morpholin-4-ylchromen-4-one

HRID 94844Notes

Reaction equation

HRID 94844 reaction equation
[CH3:1][CH2:2][N:3]=[C:4]=[N:5][CH2:6][CH2:7][CH2:8][N:9]([CH3:10])[CH3:11].[Cl:49][CH2:50][Cl:51].[F:12][c:13]1[cH:14][c:15]([NH:20][CH:21]([CH3:22])[c:23]2[cH:24][c:25]([C:40](=[O:41])[OH:42])[cH:26][c:27]3[c:28](=[O:39])[cH:29][c:30]([N:33]4[CH2:34][CH2:35][O:36][CH2:37][CH2:38]4)[o:31][c:32]23)[cH:16][c:17]([F:19])[cH:18]1.[NH:43]1[CH2:44][CH:45]([OH:48])[CH2:46][CH2:47]1>>[F:12][c:13]1[cH:14][c:15]([NH:20][CH:21]([CH3:22])[c:23]2[cH:24][c:25]([C:40](=[O:41])[N:43]3[CH2:44][CH:45]([OH:48])[CH2:46][CH2:47]3)[cH:26][c:27]3[c:28](=[O:39])[cH:29][c:30]([N:33]4[CH2:34][CH2:35][O:36][CH2:37][CH2:38]4)[o:31][c:32]23)[cH:16][c:17]([F:19])[cH:18]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 982104-HydroxypyrrolidineHCID 582349718-(1-(3,5-difluorophenylamino)ethyl)-2-morpholino-4-oxo-4H-chromene-6-carboxylic acid

Product 1

HCID 671034788-[1-(3,5-Difluoroanilino)ethyl]-6-(3-hydroxypyrrolidine-1-carbonyl)-2-morpholin-4-ylchromen-4-one

Sources & evidence

ORD record
ord-e5839bfb884d4faeae1ae8a5d0ea6108
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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