Chloride → tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-methoxy-5-((methoxy)(methyl)carbamoyl)-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

HRID 701244

Reaction equation

HRID 701244 reaction equation
[CH3:45][O:46][c:47]1[n:48][c:49]([O:50][CH3:51])[n:52][c:53]([N+:54]2([CH3:55])[CH2:56][CH2:57][O:58][CH2:59][CH2:60]2)[n:61]1.[CH3:63][O:64][NH:65][CH3:66].[CH3:67][N:68]1[CH2:69][CH2:70][O:71][CH2:72][CH2:73]1.[Cl-:44].[ClH:62].[ClH:74].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([CH2:11][N:12]([C:13]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[CH:20]1[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][n:28]3[c:29](=[O:43])[cH:30][cH:31][c:32]4[c:33]([C:40](=[O:41])[OH:42])[cH:34][c:35]([O:38][CH3:39])[cH:36][c:37]34)[CH2:24][CH2:25]1)[cH:10]2.[O:75]1[CH2:76][CH2:77][CH2:78][CH2:79]1>>[O:1]1[CH2:2][CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([CH2:11][N:12]([C:13]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[CH:20]1[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][n:28]3[c:29](=[O:43])[cH:30][cH:31][c:32]4[c:33]([C:40](=[O:42])[N:65]([O:64][CH3:63])[CH3:66])[cH:34][c:35]([O:38][CH3:39])[cH:36][c:37]34)[CH2:24][CH2:25]1)[cH:10]2

Participants

8

Reactant 7

HCID 312ChlorideHCID 313Hydrochloric Acid2×HCID 79724-MethylmorpholineHCID 8028TetrahydrofuranHCID 14232N,O-DimethylhydroxylamineHCID 27340604-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-4-methylmorpholin-4-iumHCID 59398022HCID 59398022, compound

Product 1

HCID 59398223tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-methoxy-5-((methoxy)(methyl)carbamoyl)-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

Sources & evidence

ORD record
ord-1c77ad5e74e741549b128db9a3cd697f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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