Ammonium → 3-[1-(3-methoxybenzyl)piperidin-4-yl]-4-(3-hydroxyphenyl)-3,4-dihydro-2(1H)-quinazolinone

HRID 87134Notes

Reaction equation

HRID 87134 reaction equation
[C:55]([BH3-:56])#[N:57].[C:61].[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][N:7]2[CH2:8][CH2:9][CH:10]([N:13]3[C:14](=[O:37])[NH:15][c:16]4[cH:17][cH:18][cH:19][cH:20][c:21]4[CH:22]3[c:23]3[cH:24][c:25]([O:29][CH2:30][c:31]4[cH:32][cH:33][cH:34][cH:35][cH:36]4)[cH:26][cH:27][cH:28]3)[CH2:11][CH2:12]2)[cH:38][cH:39][cH:40]1.[CH3:59][OH:60].[CH:41]([O-:42])=[O:43].[CH:45](=[O:46])[c:47]1[cH:48][cH:49][cH:50][c:51]([O:52][CH3:53])[cH:54]1.[NH4+:44].[Na+:58].[Pd:62]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][N:7]2[CH2:8][CH2:9][CH:10]([N:13]3[C:14](=[O:37])[NH:15][c:16]4[cH:17][cH:18][cH:19][cH:20][c:21]4[CH:22]3[c:23]3[cH:24][c:25]([OH:29])[cH:26][cH:27][cH:28]3)[CH2:11][CH2:12]2)[cH:38][cH:39][cH:40]1

Participants

10

Reactant 9

HCID 223AmmoniumHCID 283FormateHCID 297MethaneHCID 887MethanolHCID 923Sodium ionHCID 115693-MethoxybenzaldehydeHCID 23938PalladiumHCID 498716Cyano-borohydrideHCID 19423617HCID 19423617, compound

Product 1

HCID 194235903-[1-(3-methoxybenzyl)piperidin-4-yl]-4-(3-hydroxyphenyl)-3,4-dihydro-2(1H)-quinazolinone

Sources & evidence

ORD record
ord-93d1ee608d834427b1294ab6b5d9fcce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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