Methanol → Methyl 2-(4-((N-(3-(4-amino-2-(2-methoxyethyl)-1H-imidazo[4,5-c]quinolin-1-yl)propyl)-3-(piperidin-1-yl)propanamido)methyl)phenyl)acetate

HRID 177081Notes

Reaction equation

HRID 177081 reaction equation
[CH3:70][OH:71].[N:35]1([CH2:41][CH2:42][C:43](=[O:44])[OH:45])[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]1.[NH2:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]2[c:11]1[n:12][c:13]([CH2:31][CH2:32][O:33][CH3:34])[n:14]2[CH2:15][CH2:16][CH2:17][NH:18][CH2:19][c:20]1[cH:21][cH:22][c:23]([CH2:26][C:27](=[O:28])[O:29][CH3:30])[cH:24][cH:25]1.[O:72]=[CH:73][N:74]([CH3:75])[CH3:76].[P-:46]([F:47])([F:48])([F:49])([F:50])([F:51])[F:52].[n:53]1([O:54][C:55]([N:56]([CH3:57])[CH3:58])=[N+:59]([CH3:60])[CH3:61])[c:62]2[n:63][cH:64][cH:65][cH:66][c:67]2[n:68][n:69]1>>[NH2:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]2[c:11]1[n:12][c:13]([CH2:31][CH2:32][O:33][CH3:34])[n:14]2[CH2:15][CH2:16][CH2:17][N:18]([CH2:19][c:20]1[cH:21][cH:22][c:23]([CH2:26][C:27](=[O:28])[O:29][CH3:30])[cH:24][cH:25]1)[C:43]([CH2:42][CH2:41][N:35]1[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]1)=[O:44]

Participants

7

Reactant 6

HCID 887MethanolHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 1177821-Piperidinepropanoic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 68430910Methyl 2-(4-((3-(4-amino-2-(2-methoxyethyl)-1H-imidazo[4,5-c]quinolin-1-yl)propylamino)methyl)phenyl)acetate

Product 1

HCID 25107147Methyl 2-(4-((N-(3-(4-amino-2-(2-methoxyethyl)-1H-imidazo[4,5-c]quinolin-1-yl)propyl)-3-(piperidin-1-yl)propanamido)methyl)phenyl)acetate

Sources & evidence

ORD record
ord-0bd6cee323234de6ad30dd88e00184da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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