Products 1052250-94-8

CAS 1052250-94-8 appears in our catalog under these names: Eluxadoline Impurity 1 (R,R-Isomer), 5-((((2R)-2-Amino-3-(4-(aminocarbonyl)-2,6-dimethylphenyl)-1-oxopropyl)((1R)-1-(5-phenyl-1H-imidazol-2-yl)ethyl)amino)methyl)-2-methoxybenzoic acid (ACI). Offered by: Chemat Brand, TRC. Available pack sizes: on request, 100mg.

Eluxadoline Impurity 1 (R,R-Isomer)
Chemat Brand
  • size: on request
  • Variants: 1
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5-((((2R)-2-Amino-3-(4-(aminocarbonyl)-2,6-dimethylphenyl)-1-oxopropyl)((1R)-1-(5-phenyl-1H-imidazol-2-yl)ethyl)amino)methyl)-2-methoxybenzoic acid (ACI)
TRC
  • size: 100mg
  • Variants: 2
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Structural formula: {0} (CAS {1})

5-[[[(2R)-2-amino-3-(4-carbamoyl-2,6-dimethylphenyl)propanoyl]-[(1R)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino]methyl]-2-methoxybenzoic acid (CAS 1052250-94-8) is a chemical compound with the molecular formula C32H35N5O5 and a molecular weight of 569.6 g/mol. IUPAC name: 5-[[[(2R)-2-amino-3-(4-carbamoyl-2,6-dimethylphenyl)propanoyl]-[(1R)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino]methyl]-2-methoxybenzoic acid. InChIKey: QFNHIDANIVGXPE-FQRUVTKNSA-N.

Identity
Molecular formulaC32H35N5O5
Molecular weight569.6 g/mol
IUPAC name5-[[[(2R)-2-amino-3-(4-carbamoyl-2,6-dimethylphenyl)propanoyl]-[(1R)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino]methyl]-2-methoxybenzoic acid
InChIKeyQFNHIDANIVGXPE-FQRUVTKNSA-N
SMILESCC1=CC(=CC(=C1C[C@H](C(=O)N(CC2=CC(=C(C=C2)OC)C(=O)O)[C@H](C)C3=NC=C(N3)C4=CC=CC=C4)N)C)C(=O)N

Computed by PubChem (NCBI)

Related forms of this compound
5-[[[(2S)-2-amino-3-(4-carbamoyl-2,6-dimethylphenyl)propanoyl]-[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino]methyl]-2-methoxybenzoic acid C32H35N5O5