Dichloromethane → 1-Methyl-4-(4-{4-[(2-phenyl-5-trifluoromethyl-oxazole-4-carbonyl)-amino]-phenyl}-piperidine-1-carbonyl)-cyclohexanecarboxylic acid

HRID 108169Notes

Reaction equation

HRID 108169 reaction equation
[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[CH3:1][C:2]1([C:11](=[O:12])[OH:13])[CH2:3][CH2:4][CH:5]([C:8](=[O:9])[OH:10])[CH2:6][CH2:7]1.[CH3:48][CH2:49][N:50]([CH2:51][CH3:52])[CH2:53][CH3:54].[Cl:14][C:15](=[O:16])[Cl:17].[Cl:55][CH2:56][Cl:57].[NH:18]1[CH2:19][CH2:20][CH:21]([c:24]2[cH:25][cH:26][c:27]([NH:30][C:31](=[O:32])[c:33]3[n:34][c:35](-[c:42]4[cH:43][cH:44][cH:45][cH:46][cH:47]4)[o:36][c:37]3[C:38]([F:39])([F:40])[F:41])[cH:28][cH:29]2)[CH2:22][CH2:23]1>>[CH3:1][C:2]1([C:11](=[O:12])[OH:13])[CH2:3][CH2:4][CH:5]([C:8](=[O:10])[N:18]2[CH2:19][CH2:20][CH:21]([c:24]3[cH:25][cH:26][c:27]([NH:30][C:31](=[O:32])[c:33]4[n:34][c:35](-[c:42]5[cH:43][cH:44][cH:45][cH:46][cH:47]5)[o:36][c:37]4[C:38]([F:39])([F:40])[F:41])[cH:28][cH:29]3)[CH2:22][CH2:23]2)[CH2:6][CH2:7]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 6371PhosgeneHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 125682601-Methylcyclohexane-1,4-dicarboxylic acidHCID 529371572-Phenyl-5-trifluoromethyl-oxazole-4-carboxylic acid (4-piperidin-4-yl-phenyl)-amide

Product 1

HCID 251229241-Methyl-4-(4-{4-[(2-phenyl-5-trifluoromethyl-oxazole-4-carbonyl)-amino]-phenyl}-piperidine-1-carbonyl)-cyclohexanecarboxylic acid

Sources & evidence

ORD record
ord-88ebe863134a47c58fd7c6e606b970f7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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