4-(Trifluoromethyl)benzoyl chloride → 2-Hydroxy-5-({(4-{[(4-pentylbenzyl)amino]carbonyl}benzyl)[4-(trifluoromethyl)benzoyl]amino}methyl)benzoic acid

HRID 902800Notes

Reaction equation

HRID 902800 reaction equation
[CH2:1]([C:6]1[CH:13]=[CH:12][C:9]([CH2:10][NH2:11])=[CH:8][CH:7]=1)[CH2:2][CH2:3][CH2:4][CH3:5].Cl[CH2:15][C:16]1[CH:24]=[CH:23][C:19]([C:20](Cl)=[O:21])=[CH:18][CH:17]=1.[F:25][C:26]([F:37])([F:36])[C:27]1[CH:35]=[CH:34][C:30]([C:31](Cl)=[O:32])=[CH:29][CH:28]=1.C(O)(=O)C.[NH2:42][CH2:43][C:44]1[CH:56]=[CH:55][C:47]2[O:48]C(C)(C)[O:50][C:51](=[O:52])[C:46]=2[CH:45]=1>>[OH:48][C:47]1[CH:55]=[CH:56][C:44]([CH2:43][N:42]([CH2:15][C:16]2[CH:24]=[CH:23][C:19]([C:20]([NH:11][CH2:10][C:9]3[CH:12]=[CH:13][C:6]([CH2:1][CH2:2][CH2:3][CH2:4][CH3:5])=[CH:7][CH:8]=3)=[O:21])=[CH:18][CH:17]=2)[C:31](=[O:32])[C:30]2[CH:34]=[CH:35][C:27]([C:26]([F:37])([F:36])[F:25])=[CH:28][CH:29]=2)=[CH:45][C:46]=1[C:51]([OH:52])=[O:50]

Participants

5

Reactant 4

HCID 676074-(Trifluoromethyl)benzoyl chlorideHCID 701364-(Chloromethyl)benzoyl chlorideHCID 2775785(4-Pentylphenyl)methanamineHCID 674204786-(aminomethyl)-2,2-dimethyl-4H-1,3-benzodioxin-4-one acetate

Product 1

HCID 112850932-Hydroxy-5-({(4-{[(4-pentylbenzyl)amino]carbonyl}benzyl)[4-(trifluoromethyl)benzoyl]amino}methyl)benzoic acid

Procedure

The title compound was prepared following the procedure A using 4-pentylbenzylamine, 4-(chloromethyl)benzoyl chloride, 4-(trifluoromethyl)benzoyl chloride and 6-(aminomethyl)-2,2-dimethyl-4H-1,3-benzodioxin-4-one acetate. M+(ESI): 633.4

Sources & evidence

ORD record
ord-6ed1de33c87e4fdf89d28dc8f6da3666
Source dataset
uspto-grants-2008_04
Patent number
US07365225B2

Reaction notes

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