Hydrochloric Acid → 1-(2-{4-[Bis(4-fluorophenyl)methylene]piperidin-1-yl}-2-oxoethyl)-3,3-diphenylpiperidin-2-one

HRID 86501

Reaction equation

HRID 86501 reaction equation
[CH2:79]([Cl:80])[Cl:81].[CH:70]([N:71]([CH:72]([CH3:73])[CH3:74])[CH2:75][CH3:76])([CH3:77])[CH3:78].[ClH:24].[F:25][c:26]1[cH:27][cH:28][c:29]([C:32](=[C:33]2[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]2)[c:39]2[cH:40][cH:41][c:42]([F:45])[cH:43][cH:44]2)[cH:30][cH:31]1.[O:1]=[C:2]1[N:3]([CH2:20][C:21](=[O:22])[OH:23])[CH2:4][CH2:5][CH2:6][C:7]1([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1.[P-:46]([F:47])([F:48])([F:49])([F:50])([F:51])[F:52].[n:53]1([O:54][C:55]([N:56]([CH3:57])[CH3:58])=[N+:59]([CH3:60])[CH3:61])[c:62]2[n:63][cH:64][cH:65][cH:66][c:67]2[n:68][n:69]1>>[O:1]=[C:2]1[N:3]([CH2:20][C:21](=[O:22])[N:36]2[CH2:35][CH2:34][C:33](=[C:32]([c:29]3[cH:28][cH:27][c:26]([F:25])[cH:31][cH:30]3)[c:39]3[cH:40][cH:41][c:42]([F:45])[cH:43][cH:44]3)[CH2:38][CH2:37]2)[CH2:4][CH2:5][CH2:6][C:7]1([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 27244364-(Bis(4-fluorophenyl)methylene)piperidineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 673592802-(2-Oxo-3,3-diphenylpiperidin-1-yl)acetic acid

Product 1

HCID 673589281-(2-{4-[Bis(4-fluorophenyl)methylene]piperidin-1-yl}-2-oxoethyl)-3,3-diphenylpiperidin-2-one

Sources & evidence

ORD record
ord-b0b8be07b1e24124ba9fcc901bec8c69
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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