Water → N,N-dimethyl-2-morpholino-4-oxo-8-(1-(3,4,5-trifluorophenylamino)ethyl)-4H-chromene-6-carboxamide

HRID 675663Notes

Reaction equation

HRID 675663 reaction equation
[C:52]([O:53][Cu:54][O:55][C:56](=[O:57])[CH3:58])(=[O:59])[CH3:60].[Cl:38][CH:39]([Cl:40])[CH3:41].[Cl:48][CH2:49][Cl:50].[F:26][c:27]1[cH:28][c:29]([B:35]([OH:36])[OH:37])[cH:30][c:31]([F:34])[c:32]1[F:33].[NH2:1][CH:2]([CH3:3])[c:4]1[cH:5][c:6]([C:21](=[O:22])[N:23]([CH3:24])[CH3:25])[cH:7][c:8]2[c:9](=[O:20])[cH:10][c:11]([N:14]3[CH2:15][CH2:16][O:17][CH2:18][CH2:19]3)[o:12][c:13]12.[OH2:51].[cH:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1>>[NH:1]([CH:2]([CH3:3])[c:4]1[cH:5][c:6]([C:21](=[O:22])[N:23]([CH3:24])[CH3:25])[cH:7][c:8]2[c:9](=[O:20])[cH:10][c:11]([N:14]3[CH2:15][CH2:16][O:17][CH2:18][CH2:19]3)[o:12][c:13]12)[c:29]1[cH:28][c:27]([F:26])[c:32]([F:33])[c:31]([F:34])[cH:30]1

Participants

8

Reactant 7

HCID 962WaterHCID 1049PyridineHCID 6344DichloromethaneHCID 63651,1-DichloroethaneHCID 2734671(3,4,5-Trifluorophenyl)boronic Acid (contains varying amounts of Anhydride)HCID 582349768-(1-aminoethyl)-N,N-dimethyl-2-morpholino-4-oxo-4H-chromene-6-carboxamideHCID 178476681HCID 178476681, compound

Product 1

HCID 52913705N,N-dimethyl-2-morpholino-4-oxo-8-(1-(3,4,5-trifluorophenylamino)ethyl)-4H-chromene-6-carboxamide

Sources & evidence

ORD record
ord-8b648d290c4b4b91b29d7fe02d0a1a99
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…