Hydrochloric Acid → HCID 178515381, compound

HRID 2325759Notes

Reaction equation

HRID 2325759 reaction equation
[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:20][N:21]([CH3:22])[CH2:23][CH2:24][CH2:25][N:26]=[C:27]=[N:28][CH2:29][CH3:30].[CH3:76][N:77]([CH3:78])[CH:79]=[O:80].[ClH:19].[ClH:54].[F:31][c:32]1[cH:33][cH:34][c:35](-[c:38]2[n:39][c:40](-[c:47]3[cH:48][cH:49][c:50]([F:53])[cH:51][cH:52]3)[cH:41][c:42]([C:44](=[O:45])[OH:46])[cH:43]2)[cH:36][cH:37]1.[OH2:8].[OH:9][n:10]1[c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]2[n:17][n:18]1.[nH:55]1[n:56][n:57][n:58][c:59]1-[c:60]1[cH:61][c:62]2[c:67]([cH:68][cH:69]1)[O:66][C:65]1([CH2:64][C:63]2=[O:75])[CH2:70][CH2:71][NH:72][CH2:73][CH2:74]1>>[F:31][c:32]1[cH:33][cH:34][c:35](-[c:38]2[n:39][c:40](-[c:47]3[cH:48][cH:49][c:50]([F:53])[cH:51][cH:52]3)[cH:41][c:42]([C:44](=[O:46])[N:72]3[CH2:71][CH2:70][C:65]4([CH2:64][C:63](=[O:75])[c:62]5[cH:61][c:60](-[c:59]6[n:55][n:56][n:57][nH:58]6)[cH:69][cH:68][c:67]5[O:66]4)[CH2:74][CH2:73]3)[cH:43]2)[cH:36][cH:37]1

Participants

9

Reactant 8

HCID 313Hydrochloric Acid2×HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 463137012,6-Bis(4-fluorophenyl)pyridine-4-carboxylic acidHCID 178515376HCID 178515376, compound

Product 1

HCID 178515381HCID 178515381, compound

Sources & evidence

ORD record
ord-60a57358823c4132a9c8714160cda77f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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