Acetone → 7-[2-(4-Acetylpiperazin-1-yl)ethoxy]-4-(7-azaindol-5-yloxy)-6-methoxyquinazoline

HRID 296430Notes

Reaction equation

HRID 296430 reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([CH2:10][CH2:11][O:12][c:13]2[c:14]([O:24][CH3:25])[cH:15][c:16]3[c:17]([Cl:23])[n:18][cH:19][n:20][c:21]3[cH:22]2)[CH2:8][CH2:9]1.[C:36](=[O:37])([O-:38])[O-:39].[CH3:42][C:43](=[O:44])[CH3:45].[K+:40].[K+:41].[OH:26][c:27]1[cH:28][c:29]2[cH:30][cH:31][nH:32][c:33]2[n:34][cH:35]1>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([CH2:10][CH2:11][O:12][c:13]2[c:14]([O:24][CH3:25])[cH:15][c:16]3[c:17]([O:26][c:27]4[cH:28][c:29]5[cH:30][cH:31][nH:32][c:33]5[n:34][cH:35]4)[n:18][cH:19][n:20][c:21]3[cH:22]2)[CH2:8][CH2:9]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 220307221H-Pyrrolo[2,3-b]pyridin-5-olHCID 589602407-[2-(4-Acetylpiperazin-1-yl)ethoxy]-4-chloro-6-methoxyquinazoline

Product 1

HCID 103106907-[2-(4-Acetylpiperazin-1-yl)ethoxy]-4-(7-azaindol-5-yloxy)-6-methoxyquinazoline

Sources & evidence

ORD record
ord-be0f5ee82bbf43e6b4c33d3b5c40ee5d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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