Methanol → tert-Butyl {1-[2-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethyl]piperidin-4-yl}-carbamate

HRID 686011Notes

Reaction equation

HRID 686011 reaction equation
[CH3:15][S:16]([O:17][CH2:20][CH2:21][N:22]1[CH2:23][CH2:24][CH:25]([NH:28][C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:26][CH2:27]1)(=[O:18])=[O:19].[CH3:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:12]1)[NH:7][C:8](=[O:11])[CH2:9][O:10]2.[CH3:36][O:37][c:38]1[cH:39][c:40]2[c:41]([cH:42][cH:43][c:44](=[O:45])[n:46]2[CH2:47][CH2:48][N:49]2[CH2:50][CH2:51][CH:52]([NH:53][C:54](=[O:55])[O:56][C:57]([CH3:58])([CH3:59])[CH3:60])[CH2:61][CH2:62]2)[cH:63][cH:64]1.[CH3:65][OH:66].[Cl:67][CH2:68][Cl:69].[H-:13].[Na+:14]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:12]1)[N:7]([CH2:20][CH2:21][N:22]1[CH2:23][CH2:24][CH:25]([NH:28][C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:26][CH2:27]1)[C:8](=[O:11])[CH2:9][O:10]2

Participants

8

Reactant 7

HCID 887MethanolHCID 923Sodium ionHCID 6344DichloromethaneHCID 166653HydrideHCID 27638392H-1,4-Benzoxazine-3(4H)-one, 6-methyl-HCID 568344782-(4-((Tert-butoxycarbonyl)amino)piperidin-1-yl)ethyl methanesulfonateHCID 59371209tert-butyl {1-[2-(7-methoxy-2-oxoquinolin-1(2H)-yl)ethyl]piperidin-4-yl}carbamate

Product 1

HCID 86642624tert-Butyl {1-[2-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethyl]piperidin-4-yl}-carbamate

Sources & evidence

ORD record
ord-f9815d807cc54115ad1a1350270ca549
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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