Hydrochloric Acid → HCID 178457967, compound

HRID 185999Notes

Reaction equation

HRID 185999 reaction equation
[C:47]([CH3:48])([CH3:49])([CH3:50])[N:51]1[CH2:52][CH:53]([C:64]([OH:65])=[O:66])[CH:54]([c:56]2[c:57]([F:63])[cH:58][c:59]([F:62])[cH:60][cH:61]2)[CH2:55]1.[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[O:9][C:10](=[O:11])[NH:12][CH:13]([CH2:14][CH3:15])[c:16]1[c:17]([CH:24]2[CH2:25][CH2:26][N:27]([C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:28][CH2:29]2)[cH:18][c:19]([CH3:23])[c:20]([CH3:22])[cH:21]1.[CH3:91][CH2:92][O:93][C:94]([CH3:95])=[O:96].[CH:37]([N:38]([CH2:39][CH3:40])[CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45].[Cl:97][CH2:98][Cl:99].[ClH:1].[ClH:46].[OH2:100].[P-:67]([F:68])([F:69])([F:70])([F:71])([F:72])[F:73].[n:74]1([O:75][C:76]([N:77]([CH3:78])[CH3:79])=[N+:80]([CH3:81])[CH3:82])[c:83]2[n:84][cH:85][cH:86][cH:87][c:88]2[n:89][n:90]1>>[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[O:9][C:10](=[O:11])[NH:12][CH:13]([CH2:14][CH3:15])[c:16]1[c:17]([CH:24]2[CH2:25][CH2:26][N:27]([C:30](=[O:31])[CH:53]3[CH2:52][N:51]([C:47]([CH3:48])([CH3:49])[CH3:50])[CH2:55][CH:54]3[c:56]3[c:57]([F:63])[cH:58][c:59]([F:62])[cH:60][cH:61]3)[CH2:28][CH2:29]2)[cH:18][c:19]([CH3:23])[c:20]([CH3:22])[cH:21]1

Participants

10

Reactant 9

HCID 313Hydrochloric Acid2×HCID 962WaterHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 226407651-tert-Butyl-4-(2,4-difluorophenyl)pyrrolidine-3-carboxylic acidHCID 178457968tert-butyl 4-[4,5-dimethyl-2-[1-(phenylmethoxycarbonylamino)propyl]phenyl]piperidine-1-carboxylate

Product 1

HCID 178457967HCID 178457967, compound

Sources & evidence

ORD record
ord-a7a7154e88a0424eb9c4605c74ac1a03
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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