Hydrochloric Acid → 4-fluoro-N-{(1RS,2RS)-2-hydroxy-2-(2-phenyl-1,3-thiazol-4-yl)-1-[3-(1,1,2,2-tetrafluoroethoxy)benzyl]ethyl}-1-naphthamide

HRID 1221955Notes

Reaction equation

HRID 1221955 reaction equation
[CH2:56]([N:57]=[C:58]=[N:59][CH2:60][CH2:61][CH2:62][N:63]([CH3:64])[CH3:65])[CH3:66].[CH3:67][N:68]([CH3:69])[CH:70]=[O:71].[CH3:72][CH2:73][O:74][C:75](=[O:76])[CH3:77].[ClH:55].[F:30][c:31]1[cH:32][cH:33][c:34]([C:41](=[O:42])[OH:43])[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]12.[NH2:1][CH:2]([CH:3]([OH:4])[c:5]1[n:6][c:7](-[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[s:8][cH:9]1)[CH2:16][c:17]1[cH:18][c:19]([O:23][C:24]([CH:25]([F:26])[F:27])([F:28])[F:29])[cH:20][cH:21][cH:22]1.[OH2:44].[OH:45][n:46]1[c:47]2[cH:48][cH:49][cH:50][cH:51][c:52]2[n:53][n:54]1>>[NH:1]([CH:2]([CH:3]([OH:4])[c:5]1[n:6][c:7](-[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[s:8][cH:9]1)[CH2:16][c:17]1[cH:18][c:19]([O:23][C:24]([CH:25]([F:26])[F:27])([F:28])[F:29])[cH:20][cH:21][cH:22]1)[C:41]([c:34]1[cH:33][cH:32][c:31]([F:30])[c:40]2[c:35]1[cH:36][cH:37][cH:38][cH:39]2)=[O:42]

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 684484-Fluoro-1-naphthoic acidHCID 757711-HydroxybenzotriazoleHCID 22261593(1RS,2RS)-2-amino-1-(2-phenyl-1,3-thiazol-4-yl)-3-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-1-propanol

Product 1

HCID 222616904-fluoro-N-{(1RS,2RS)-2-hydroxy-2-(2-phenyl-1,3-thiazol-4-yl)-1-[3-(1,1,2,2-tetrafluoroethoxy)benzyl]ethyl}-1-naphthamide

Sources & evidence

ORD record
ord-5f4e0a2929434dc3a1efc68b5ab121e8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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