Dichloromethane → 3-(4-methoxy-phenyl)-1-(trans-4-hydroxy-cyclohexyl)-7-(3,4-dimethoxy-phenylamino)-3,4-dihydro-1H-pyrimido[4,5-d]pyrimidin-2-one

HRID 321595Notes

Reaction equation

HRID 321595 reaction equation
[C:1]([Si:2]([CH3:3])([CH3:4])[O:6][CH:7]1[CH2:8][CH2:9][CH:10]([N:13]2[C:14](=[O:42])[N:15]([c:34]3[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]3)[CH2:16][c:17]3[c:18]2[n:19][c:20]([NH:23][c:24]2[cH:25][c:26]([O:32][CH3:33])[c:27]([O:30][CH3:31])[cH:28][cH:29]2)[n:21][cH:22]3)[CH2:11][CH2:12]1)([CH3:5])([CH3:43])[CH3:44].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[Cl:52][CH2:53][Cl:54].[OH:45][C:46]([C:47]([F:48])([F:49])[F:50])=[O:51]>>[OH:6][CH:7]1[CH2:8][CH2:9][CH:10]([N:13]2[C:14](=[O:42])[N:15]([c:34]3[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]3)[CH2:16][c:17]3[c:18]2[n:19][c:20]([NH:23][c:24]2[cH:25][c:26]([O:32][CH3:33])[c:27]([O:30][CH3:31])[cH:28][cH:29]2)[n:21][cH:22]3)[CH2:11][CH2:12]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 113425661-[trans-4-(tert-butyl-dimethyl-silanyloxy)-cyclohexyl]-3-(4-methoxy-phenyl)-7-(3,4-dimethoxy-phenylamino)-3,4-dihydro-1H-pyrimido[4,5-d]pyrimidin-2-one

Product 1

HCID 112835193-(4-methoxy-phenyl)-1-(trans-4-hydroxy-cyclohexyl)-7-(3,4-dimethoxy-phenylamino)-3,4-dihydro-1H-pyrimido[4,5-d]pyrimidin-2-one

Sources & evidence

ORD record
ord-824c3d43ec744c77b1dabffe1862fc94
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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