Hydrochloric Acid → HCID 68638800, compound

HRID 2328271

Reaction equation

HRID 2328271 reaction equation
[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[Cl:19][CH2:20][CH2:21][CH2:22][O:23][c:24]1[cH:25][cH:26][c:27]2[c:28]([NH:34][c:35]3[cH:36][n:37][n:38]([CH2:40][C:41](=[O:42])[OH:43])[cH:39]3)[n:29][cH:30][n:31][c:32]2[cH:33]1.[ClH:57].[F:1][C:2]([F:3])([F:4])[C:5]([O:6][c:7]1[c:8]([F:9])[c:10]([F:11])[c:12]([F:13])[c:14]([F:15])[c:16]1[F:17])=[O:18].[NH2:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[cH:44]1[cH:45][cH:46][n:47][cH:48][cH:49]1>>[Cl:19][CH2:20][CH2:21][CH2:22][O:23][c:24]1[cH:25][cH:26][c:27]2[c:28]([NH:34][c:35]3[cH:36][n:37][n:38]([CH2:40][C:41](=[O:42])[NH:50][c:51]4[cH:52][cH:53][cH:54][cH:55][cH:56]4)[cH:39]3)[n:29][cH:30][n:31][c:32]2[cH:33]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 1049PyridineHCID 6115AnilineHCID 6228DimethylformamideHCID 4327891Pentafluorophenyl TrifluoroacetateHCID 68638745(4-{[7-(3-chloropropoxy)quinazolin-4-yl]amino}-1H-pyrazol-1-yl)acetic acid

Product 1

HCID 68638800HCID 68638800, compound

Sources & evidence

ORD record
ord-4e1cc61d56f64ab8a08f81b6c5688d37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Linked notes

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