Sodium ion → 2-{4-[(1-Cyclobutylpiperidin-4-yl)oxy]phenyl}-3-methyl-3,7-dihydropyrido[3,4-d]pyrimidine-4,8-dione

HRID 678350Notes

Reaction equation

HRID 678350 reaction equation
[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[CH:1]1([N:5]2[CH2:6][CH2:7][CH:8]([O:11][c:12]3[cH:13][cH:14][c:15](-[c:18]4[n:19]([CH3:31])[c:20](=[O:30])[c:21]5[c:22]([n:23]4)[c:24]([O:28][CH3:29])[n:25][cH:26][cH:27]5)[cH:16][cH:17]3)[CH2:9][CH2:10]2)[CH2:2][CH2:3][CH2:4]1.[Cl:38][CH2:39][Cl:40].[F:32][B:33]([F:34])[F:35].[Na+:37].[OH-:36]>>[CH:1]1([N:5]2[CH2:6][CH2:7][CH:8]([O:11][c:12]3[cH:13][cH:14][c:15](-[c:18]4[n:19]([CH3:31])[c:20](=[O:30])[c:21]5[c:22]([n:23]4)[c:24](=[O:28])[nH:25][cH:26][cH:27]5)[cH:16][cH:17]3)[CH2:9][CH2:10]2)[CH2:2][CH2:3][CH2:4]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 961HydroxideHCID 6344DichloromethaneHCID 6356Boron trifluorideHCID 8857Ethyl AcetateHCID 11539020Pyrido[3,4-d]pyrimidin-4(3H)-one, 2-[4-[(1-cyclobutyl-4-piperidinyl)oxy]phenyl]-8-methoxy-3-methyl-

Product 1

HCID 672438532-{4-[(1-Cyclobutylpiperidin-4-yl)oxy]phenyl}-3-methyl-3,7-dihydropyrido[3,4-d]pyrimidine-4,8-dione

Sources & evidence

ORD record
ord-d8988752758e409d94f93888d6fae065
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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