Ibuprofen Methocarbamol Ester (Mixture of Diastereomers)

CAS: 111632-17-8

Ref. TR-I140050

Product Information

• Name: Ibuprofen Methocarbamol Ester (Mixture of Diastereomers)
• Synonyms: alpha-Methyl-4-(2-methylpropyl)-1-[[(aminocarbonyl)oxy]methyl]-2-(2-methoxyphenoxy)ethyl Ester Benzeneacetic Acid, 1-[[(Aminocarbonyl)oxy]methyl]-2-(2-methoxyphenoxy)ethyl α-methyl-4-(2-methylpropyl)benzeneacetate, Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, 1-[[(aminocarbonyl)oxy]methyl]-2-(2-methoxyphenoxy)ethyl ester, Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, 2-[(aminocarbonyl)oxy]-1-[(2-methoxyphenoxy)methyl]ethyl ester, Ibuprofen methocarbamol ester

Description

Applications Ibuprofen Methocarbamol Ester is the condensation product of Ibuprofen (I140000) and methocarbamol (M225950). Various studies have been done to investigate the ability of Ibuprofen Methocarbamol Ester as an both antiinflammatory and muscle relaxant.
References Topliss, J., et al.: J. Med. Chem., 22, 1238 (1979), Walters, W., et al.: Drug Discov. Today., 3, 160 (1998), Baldi, P., et al.: Bioinformatics, 16, 412 (2000), Kouznetsov, V., et al.: J. Arch. Pharm., 337, 127 (2004), Busson, M., et al.: J. Int. Med Res., 14, 53 (1986), Meade, E.A., et al.: J. Biol. Chem., 268, 6610 (1993), Davies, N.M., et al.: Clin. Pharmacokinet., 34, 101 (1998),

• Brand: TRC

Chemical properties

• Molecular weight: 429.51
• Formula: C₂₄H₃₁NO₆
• Color/Form: Off-White Solid
• InChI: InChI=1S/C24H31NO6/c1-16(2)13-18-9-11-19(12-10-18)17(3)23(26)31-20(15-30-24(25)27)14-29-22-8-6-5-7-21(22)28-4/h5-12,16-17,20H,13-15H2,1-4H3,(H2,25,27)
• InChI key: InChIKey=DAMPDGWOAVJJEN-UHFFFAOYSA-N
• SMILES: COc1ccccc1OCC(COC(N)=O)OC(=O)C(C)c1ccc(CC(C)C)cc1