Dichloromethane → N-(1-(5-(5-chloro-3-fluoro-2-(2-methyl-2H-tetrazol-5-yl)phenyl)-3-fluoropyridin-2-yl)ethyl)-3,3-difluoro-1-hydroxycyclopentanecarboxamide

HRID 172403Notes

Reaction equation

HRID 172403 reaction equation
[CH3:63][CH2:64][N:65]([CH2:66][CH3:67])[CH2:68][CH3:69].[CH3:73][CH2:74][O:75][C:76]([CH3:77])=[O:78].[Cl:1][c:2]1[cH:3][c:4]([F:24])[c:5](-[c:18]2[n:19][n:20][n:21]([CH3:23])[n:22]2)[c:6](-[c:8]2[cH:9][c:10]([F:17])[c:11]([CH:14]([CH3:15])[NH2:16])[n:12][cH:13]2)[cH:7]1.[Cl:70][CH2:71][Cl:72].[F:25][C:26]1([F:35])[CH2:27][C:28]([C:31](=[O:32])[OH:33])([OH:34])[CH2:29][CH2:30]1.[P-:36]([F:37])([F:38])([F:39])([F:40])([F:41])[F:42].[n:43]1([O:44][P+:45]([N:46]([CH3:47])[CH3:48])([N:49]([CH3:50])[CH3:51])[N:52]([CH3:53])[CH3:54])[c:55]2[cH:56][cH:57][cH:58][cH:59][c:60]2[n:61][n:62]1>>[Cl:1][c:2]1[cH:3][c:4]([F:24])[c:5](-[c:18]2[n:19][n:20][n:21]([CH3:23])[n:22]2)[c:6](-[c:8]2[cH:9][c:10]([F:17])[c:11]([CH:14]([CH3:15])[NH:16][C:31]([C:28]3([OH:34])[CH2:27][C:26]([F:25])([F:35])[CH2:30][CH2:29]3)=[O:32])[n:12][cH:13]2)[cH:7]1

Participants

8

Reactant 7

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 124335Benzotriazol-1-yloxy-tris(dimethylamino)phosphoniumHCID 68715806(+)-3,3-Difluoro-1-hydroxycyclopentanecarboxylic acidHCID 178463406HCID 178463406, compound

Product 1

HCID 44593650N-(1-(5-(5-chloro-3-fluoro-2-(2-methyl-2H-tetrazol-5-yl)phenyl)-3-fluoropyridin-2-yl)ethyl)-3,3-difluoro-1-hydroxycyclopentanecarboxamide

Sources & evidence

ORD record
ord-0e14cef2f85a450faa8c96d3d7befbdf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…