Hydrochloric Acid → (3-(4-((3-(Difluoromethyl)azetidin-1-yl)methyl)phenoxy)azetidin-1-yl)(5-phenyl-1,3,4-oxadiazol-2-yl)methanone

HRID 107329Notes

Reaction equation

HRID 107329 reaction equation
[C:44]([O:45][BH-:46]([O:47][C:48](=[O:49])[CH3:50])[O:51][C:52](=[O:53])[CH3:54])(=[O:55])[CH3:56].[CH:35]([N:36]([CH2:37][CH3:38])[CH:39]([CH3:40])[CH3:41])([CH3:42])[CH3:43].[Cl:58][CH2:59][Cl:60].[ClH:27].[F:28][CH:29]([CH:30]1[CH2:31][NH:32][CH2:33]1)[F:34].[Na+:57].[c:1]1(-[c:7]2[n:8][n:9][c:10]([C:12](=[O:13])[N:14]3[CH2:15][CH:16]([O:18][c:19]4[cH:20][cH:21][c:22]([CH:23]=[O:24])[cH:25][cH:26]4)[CH2:17]3)[o:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[n:8][n:9][c:10]([C:12](=[O:13])[N:14]3[CH2:15][CH:16]([O:18][c:19]4[cH:20][cH:21][c:22]([CH2:23][N:32]5[CH2:31][CH:30]([CH:29]([F:28])[F:34])[CH2:33]5)[cH:25][cH:26]4)[CH2:17]3)[o:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 2724942TriacetoxyborohydrideHCID 552994833-(Difluoromethyl)azetidineHCID 58043115HCID 58043115, compound

Product 1

HCID 56598797(3-(4-((3-(Difluoromethyl)azetidin-1-yl)methyl)phenoxy)azetidin-1-yl)(5-phenyl-1,3,4-oxadiazol-2-yl)methanone

Sources & evidence

ORD record
ord-aa6dbb2b481e48bf8c470d5238d4d331
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…