Hydrochloric Acid → Hydrochloric Acid

HRID 1569918Notes

Reaction equation

HRID 1569918 reaction equation
[C:1]([c:2]1[cH:3][cH:4][n:5][cH:6][cH:7]1)(=[O:8])[Cl:9].[CH2:45]([Cl:46])[Cl:47].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[Cl:12][c:13]1[cH:14][c:15]([F:37])[c:16]([NH:17][c:18]2[n:19][cH:20][n:21][c:22]3[cH:23][c:24]([O:30][CH2:31][CH2:32][NH:33][CH3:34])[c:25]([O:28][CH3:29])[cH:26][c:27]23)[cH:35][cH:36]1.[ClH:11].[OH2:10]>>[C:1]([c:2]1[cH:3][cH:4][n:5][cH:6][cH:7]1)(=[O:8])[N:33]([CH2:32][CH2:31][O:30][c:24]1[cH:23][c:22]2[n:21][cH:20][n:19][c:18]([NH:17][c:16]3[c:15]([F:37])[cH:14][c:13]([Cl:12])[cH:36][cH:35]3)[c:27]2[cH:26][c:25]1[O:28][CH3:29])[CH3:34].[ClH:9]

Participants

8

Reactant 6

HCID 313Hydrochloric AcidHCID 962WaterHCID 6344DichloromethaneHCID 8471TriethylamineHCID 417436Pyridine-4-carbonyl chlorideHCID 224781924-(4-Chloro-2-fluoroanilino)-6-methoxy-7-(2-methylaminoethoxy)quinazoline

Product 2

HCID 313Hydrochloric AcidHCID 22625012N-[2-[4-(4-chloro-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxyethyl]-N-methylpyridine-4-carboxamide

Sources & evidence

ORD record
ord-a699d5c173aa467e82655100b1dd85db
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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