Products 864825-13-8

CAS 864825-13-8 appears in our catalog under these names: Eluxadoline Dihydrochloride, Eluxadoline Dihydrochloride, Eluxadoline-d3 dihydrochloride. Offered by: TRC, GLPBio, Biosynth. Available pack sizes: 25mg, 10mg, 5mg, 1mg, 50mg.

Structural formula: {0} (CAS {1})

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;dihydrochloride (CAS 864825-13-8) is a chemical compound with the molecular formula C32H37Cl2N5O5 and a molecular weight of 642.6 g/mol. IUPAC name: 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;dihydrochloride. InChIKey: YFUUQKJOCLQHMZ-ISJKLOBTSA-N.

Identity
Molecular formulaC32H37Cl2N5O5
Molecular weight642.6 g/mol
IUPAC name5-[[[(2S)-2-amino-3-(4-carbamoyl-2,6-dimethylphenyl)propanoyl]-[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino]methyl]-2-methoxybenzoic acid;dihydrochloride
InChIKeyYFUUQKJOCLQHMZ-ISJKLOBTSA-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.Cl.Cl

Computed by PubChem (NCBI)