Hydrochloric Acid → HCID 178424550, compound

HRID 149572Notes

Reaction equation

HRID 149572 reaction equation
[CH:46]([N:47]([CH2:48][CH3:49])[CH:50]([CH3:51])[CH3:52])([CH3:53])[CH3:54].[ClH:1].[F:30][c:31]1[cH:32][c:33]([CH:38]2[NH:39][CH2:40][C:41]([CH3:44])([CH3:45])[CH2:42][CH2:43]2)[cH:34][c:35]([F:37])[cH:36]1.[O:2]=[C:3]1[NH:4][c:5]2[n:6][cH:7][cH:8][cH:9][c:10]2[C:11]12[CH2:12][c:13]1[cH:14][cH:15][c:16]([NH:20][c:21]3[cH:22][c:23]([C:27](=[O:28])[OH:29])[n:24][cH:25][n:26]3)[cH:17][c:18]1[CH2:19]2.[O:55]=[CH:56][N:57]([CH3:58])[CH3:59]>>[O:2]=[C:3]1[NH:4][c:5]2[n:6][cH:7][cH:8][cH:9][c:10]2[C:11]12[CH2:12][c:13]1[cH:14][cH:15][c:16]([NH:20][c:21]3[cH:22][c:23]([C:27](=[O:29])[N:39]4[CH:38]([c:33]5[cH:32][c:31]([F:30])[cH:36][c:35]([F:37])[cH:34]5)[CH2:43][CH2:42][C:41]([CH3:44])([CH3:45])[CH2:40]4)[n:24][cH:25][n:26]3)[cH:17][c:18]1[CH2:19]2

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 81531DiisopropylethylamineHCID 581174936-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]pyrimidine-4-carboxylic acidHCID 667222322-(3,5-Difluorophenyl)-5,5-dimethylpiperidine

Product 1

HCID 178424550HCID 178424550, compound

Sources & evidence

ORD record
ord-b5e9234c49464ab18dfd9054b5b6a640
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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