Water → 1-Cyclohexyl-5-[4-(4-hydroxy-1-methyl-4-piperidinyl)-2-methoxyphenyl]-3-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one

HRID 187288Notes

Reaction equation

HRID 187288 reaction equation
[Br:11][c:12]1[cH:13][c:14]([O:35][CH3:36])[c:15](-[c:18]2[nH:19][c:20](=[O:34])[c:21]3[c:22]([n:23]2)[c:24]([CH3:33])[n:25][n:26]3[CH:27]2[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]2)[cH:16][cH:17]1.[CH2:1]([Li:2])[CH2:3][CH2:4][CH3:5].[CH3:37][N:38]1[CH2:39][CH2:40][C:41](=[O:44])[CH2:42][CH2:43]1.[O:6]1[CH2:7][CH2:8][CH2:9][CH2:10]1.[OH2:45]>>[c:12]1([C:41]2([OH:44])[CH2:40][CH2:39][N:38]([CH3:37])[CH2:43][CH2:42]2)[cH:13][c:14]([O:35][CH3:36])[c:15](-[c:18]2[nH:19][c:20](=[O:34])[c:21]3[c:22]([n:23]2)[c:24]([CH3:33])[n:25][n:26]3[CH:27]2[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]2)[cH:16][cH:17]1

Participants

6

Reactant 5

HCID 962WaterHCID 8028TetrahydrofuranHCID 740491-Methyl-4-piperidoneHCID 136005882HCID 136005882, compoundHCID 178418339Butyllithium

Product 1

HCID 1360059331-Cyclohexyl-5-[4-(4-hydroxy-1-methyl-4-piperidinyl)-2-methoxyphenyl]-3-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one

Sources & evidence

ORD record
ord-1d40930b67884ec68d6b83ca6525bd71
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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