| Identification | Back Directory | [Name]
2-[3-(AMinocarbonyl)-4-(2-Methylpropoxy)phenyl]-4-Methyl-5-thiazolecarboxylic Acid | [CAS]
1239233-86-3 | [Synonyms]
Febuxostat-1
Febuxostat Amide
Febuxostat Impurity D
Febuxostat Amide Impurity
Febuxostat Impurity 4 (A)
Febuxostat Related CoMpound
Febuxostat Related Compound A
2-(3-carbamoyl-4-isobutoxyphenyl)
Febuxostat Related Compound (Febuxostat Impurity 4 )
2-(3-Carbamoyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylic acid
2-[3-carbamoyl-4-(2-methylpropoxy)phenyl]-4-methyl-5-thiazole carboxylic acid
2-[3-(AMinocarbonyl)-4-(2-Methylpropoxy)phenyl]-4-Methyl-5-thiazolecarboxylic Acid
5-Thiazolecarboxylic acid, 2-[3-(aminocarbonyl)-4-(2-methylpropoxy)phenyl]-4-methyl-
Febuxostat Impurity 10/Febuxostat Amide Impurity/2-(3-carbamoyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylic acid | [Molecular Formula]
C16H18N2O4S | [MDL Number]
MFCD28138169 | [MOL File]
1239233-86-3.mol | [Molecular Weight]
334.39 |
| Chemical Properties | Back Directory | [Melting point ]
225-228°C | [Boiling point ]
538.9±60.0 °C(Predicted) | [density ]
1.291±0.06 g/cm3(Predicted) | [storage temp. ]
Refrigerator | [solubility ]
DMSO (Slightly), Methanol (Slightly) | [form ]
Solid | [pka]
1.22±0.37(Predicted) | [color ]
White to Off-White | [InChI]
InChI=1S/C16H18N2O4S/c1-8(2)7-22-12-5-4-10(6-11(12)14(17)19)15-18-9(3)13(23-15)16(20)21/h4-6,8H,7H2,1-3H3,(H2,17,19)(H,20,21) | [InChIKey]
ITMGNZBRUWAGOZ-UHFFFAOYSA-N | [SMILES]
S1C(C(O)=O)=C(C)N=C1C1=CC=C(OCC(C)C)C(C(N)=O)=C1 |
| Hazard Information | Back Directory | [Uses]
2-[3-(Aminocarbonyl)-4-(2-methylpropoxy)phenyl]-4-methyl-5-thiazolecarboxylic acid is an impurity of Febuxostat (F229000), an xanthine oxidase/xanthine dehydrogenase inhibitor used for the treatment of hyperuricemia and chronic gout. |
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