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

HRID 902796Notes

Reaction equation

HRID 902796 reaction equation
[CH2:1]([NH2:9])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8].Cl[CH2:11][C:12]1[CH:20]=[CH:19][C:15]([C:16](Cl)=[O:17])=[CH:14][CH:13]=1.[F:21][C:22]([F:33])([F:32])[C:23]1[CH:31]=[CH:30][C:26]([C:27](Cl)=[O:28])=[CH:25][CH:24]=1.C(O)(=O)C.[NH2:38][CH2:39][C:40]1[CH:52]=[CH:51][C:43]2[O:44]C(C)(C)[O:46][C:47](=[O:48])[C:42]=2[CH:41]=1>>[OH:44][C:43]1[CH:51]=[CH:52][C:40]([CH2:39][N:38]([CH2:11][C:12]2[CH:20]=[CH:19][C:15]([C:16]([NH:9][CH2:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])=[O:17])=[CH:14][CH:13]=2)[C:27](=[O:28])[C:26]2[CH:30]=[CH:31][C:23]([C:22]([F:33])([F:32])[F:21])=[CH:24][CH:25]=2)=[CH:41][C:42]=1[C:47]([OH:48])=[O:46]

Participants

5

Reactant 4

HCID 8143OctylamineHCID 676074-(Trifluoromethyl)benzoyl chlorideHCID 701364-(Chloromethyl)benzoyl chlorideHCID 674204786-(aminomethyl)-2,2-dimethyl-4H-1,3-benzodioxin-4-one acetate

Product 1

HCID 112386172-Hydroxy-5-({{4-[(octylamino)carbonyl]benzyl}[4-(trifluoromethyl)benzoyl]amino}methyl)benzoic acid

Procedure

The title compound was prepared following the procedure A using octylamine, 4-(chloromethyl)benzoyl chloride, 4-(trifluoromethyl)benzoyl chloride and 6-(aminomethyl)-2,2-dimethyl-4H-1,3-benzodioxin-4-one acetate. M+(ESI): 585.4

Sources & evidence

ORD record
ord-f24c2ebb5c5343eeaf9e300eb6d57fed
Source dataset
uspto-grants-2008_04
Patent number
US07365225B2

Reaction notes

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