Methanol → 4,4-Diethyl-1-{3-[2-hydroxy-2-(7-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethylamino]-3-methylbutyl}-1,4-dihydrobenzo[d][1,3]oxazin-2-one

HRID 2346841Notes

Reaction equation

HRID 2346841 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([CH:20]([CH2:21][NH:22][C:23]([CH2:24][CH2:25][N:26]2[C:27](=[O:40])[O:28][C:29]([CH2:36][CH3:37])([CH2:38][CH3:39])[c:30]3[c:31]2[cH:32][cH:33][cH:34][cH:35]3)([CH3:41])[CH3:42])[OH:43])[c:12]2[cH:13][cH:14][c:15](=[O:19])[nH:16][c:17]2[cH:18]1.[CH3:46][OH:47].[H:44][H:45]>>[OH:8][c:9]1[cH:10][c:11]([CH:20]([CH2:21][NH:22][C:23]([CH2:24][CH2:25][N:26]2[C:27](=[O:40])[O:28][C:29]([CH2:36][CH3:37])([CH2:38][CH3:39])[c:30]3[c:31]2[cH:32][cH:33][cH:34][cH:35]3)([CH3:41])[CH3:42])[OH:43])[c:12]2[cH:13][cH:14][c:15](=[O:19])[nH:16][c:17]2[cH:18]1

Participants

4

Reactant 3

HCID 887MethanolHCID 210728131-{3-[2-(7-Benzyloxy-2-oxo-1,2-dihydroquinolin-5-yl)-2-hydroxyethylamino]-3-methylbutyl}-4,4-diethyl-1,4-dihydrobenzo[d][1,3]oxazin-2-oneHCID 178418361HCID 178418361, compound

Product 1

HCID 210728434,4-Diethyl-1-{3-[2-hydroxy-2-(7-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethylamino]-3-methylbutyl}-1,4-dihydrobenzo[d][1,3]oxazin-2-one

Sources & evidence

ORD record
ord-8cf88719cbd8443394ced5827f29d44f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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