Hydrochloric Acid → Hydrochloric Acid

HRID 696795Notes

Reaction equation

HRID 696795 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:20][CH3:21])[cH:11][c:12]2[c:13]([Cl:19])[n:14][cH:15][n:16][c:17]2[cH:18]1.[ClH:38].[NH2:22][c:23]1[cH:24][n:25][c:26]([NH:29][C:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)=[O:37])[n:27][cH:28]1.[O:39]1[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:20][CH3:21])[cH:11][c:12]2[c:13]([NH:22][c:23]3[cH:24][n:25][c:26]([NH:29][C:30]([c:31]4[cH:32][cH:33][cH:34][cH:35][cH:36]4)=[O:37])[n:27][cH:28]3)[n:14][cH:15][n:16][c:17]2[cH:18]1.[ClH:19].[ClH:38]

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 106619987-(Benzyloxy)-4-chloro-6-methoxyquinazolineHCID 11499482N-(5-aminopyrimidin-2-yl)benzamide

Product 2

HCID 313Hydrochloric Acid2×HCID 21114583N-[5-[(6-methoxy-7-phenylmethoxyquinazolin-4-yl)amino]pyrimidin-2-yl]benzamide

Sources & evidence

ORD record
ord-6f785f2761104826a22af2cbff9fea88
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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