Serinol → 1-Cyclopentyl-3-(2,6-difluoro-3,5-dimethoxy-phenyl)-7-(2-hydroxy-1-hydroxymethyl-ethylamino)-3,4-dihydro-1H-pyrimido[4,5-d]pyrimidin-2-one

HRID 676374Notes

Reaction equation

HRID 676374 reaction equation
[CH:1]1([N:6]2[C:7](=[O:31])[N:8]([c:19]3[c:20]([F:30])[c:21]([O:28][CH3:29])[cH:22][c:23]([O:26][CH3:27])[c:24]3[F:25])[CH2:9][c:10]3[c:11]2[n:12][c:13]([S:16]([CH3:17])=[O:18])[n:14][cH:15]3)[CH2:2][CH2:3][CH2:4][CH2:5]1.[NH2:32][CH:33]([CH2:34][OH:35])[CH2:36][OH:37]>>[CH:1]1([N:6]2[C:7](=[O:31])[N:8]([c:19]3[c:20]([F:30])[c:21]([O:28][CH3:29])[cH:22][c:23]([O:26][CH3:27])[c:24]3[F:25])[CH2:9][c:10]3[c:11]2[n:12][c:13]([NH:32][CH:33]([CH2:34][OH:35])[CH2:36][OH:37])[n:14][cH:15]3)[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

3

Reactant 2

HCID 68294SerinolHCID 184448441-Cyclopentyl-3-(2,6-difluoro-3,5-dimethoxyphenyl)-7-(methylsulfinyl)-3,4-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one

Product 1

HCID 100738381-Cyclopentyl-3-(2,6-difluoro-3,5-dimethoxy-phenyl)-7-(2-hydroxy-1-hydroxymethyl-ethylamino)-3,4-dihydro-1H-pyrimido[4,5-d]pyrimidin-2-one

Sources & evidence

ORD record
ord-05d68d805cc94493bedad0a102e37634
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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