Hydrochloric Acid → 6-(4-methylpyrrolidin-3-yl)-1-(oxan-4-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one

HRID 682203Notes

Reaction equation

HRID 682203 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]([c:14]2[nH:15][c:16](=[O:29])[c:17]3[c:18]([n:19]2)[n:20]([CH:23]2[CH2:24][CH2:25][O:26][CH2:27][CH2:28]2)[n:21][cH:22]3)[CH:11]([CH3:13])[CH2:12]1.[CH3:31][OH:32].[ClH:30].[OH-:33].[OH-:35].[Pd+2:34]>>[NH:8]1[CH2:9][CH:10]([c:14]2[nH:15][c:16](=[O:29])[c:17]3[c:18]([n:19]2)[n:20]([CH:23]2[CH2:24][CH2:25][O:26][CH2:27][CH2:28]2)[n:21][cH:22]3)[CH:11]([CH3:13])[CH2:12]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 887MethanolHCID 961Hydroxide2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 1362198764H-Pyrazolo[3,4-d]pyrimidin-4-one, 1,5-dihydro-6-[(3R,4R)-4-methyl-1-(phenylmethyl)-3-pyrrolidinyl]-1-(tetrahydro-2H-pyran-4-yl)-

Product 1

HCID 1369595726-(4-methylpyrrolidin-3-yl)-1-(oxan-4-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one

Sources & evidence

ORD record
ord-146cbc132dca4a5891568040682265b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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