Hydrochloric Acid → N-({1-[4-Hydroxy-4-(6-methoxy-pyridin-3-yl)-cyclohexyl]-azetidin-3-ylcarbamoyl}-methyl)-3-trifluoromethyl-benzamide

HRID 307930Notes

Reaction equation

HRID 307930 reaction equation
[Cl:39][CH2:40][Cl:41].[ClH:38].[NH:17]1[CH2:18][CH:19]([NH:21][C:22](=[O:23])[CH2:24][NH:25][C:26]([c:27]2[cH:28][c:29]([C:33]([F:34])([F:35])[F:36])[cH:30][cH:31][cH:32]2)=[O:37])[CH2:20]1.[OH:1][C:2]1([c:9]2[cH:10][n:11][c:12]([O:15][CH3:16])[cH:13][cH:14]2)[CH2:3][CH2:4][C:5](=[O:8])[CH2:6][CH2:7]1>>[OH:1][C:2]1([c:9]2[cH:10][n:11][c:12]([O:15][CH3:16])[cH:13][cH:14]2)[CH2:3][CH2:4][CH:5]([N:17]2[CH2:18][CH:19]([NH:21][C:22](=[O:23])[CH2:24][NH:25][C:26]([c:27]3[cH:28][c:29]([C:33]([F:34])([F:35])[F:36])[cH:30][cH:31][cH:32]3)=[O:37])[CH2:20]2)[CH2:6][CH2:7]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 529879954-Hydroxy-4-(6-methoxypyridin-3-YL)cyclohexanoneHCID 59361594N-(azetidin-3-ylcarbamoylmethyl)-3-trifluoromethyl-benzamide

Product 1

HCID 46241509N-({1-[4-Hydroxy-4-(6-methoxy-pyridin-3-yl)-cyclohexyl]-azetidin-3-ylcarbamoyl}-methyl)-3-trifluoromethyl-benzamide

Sources & evidence

ORD record
ord-b34b3b77b86f42e0bd36e90a54f445a4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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