Eluxadoline Related Compound 1

Product Name Eluxadoline Related Compound 1
Alternate Names Eluxadoline Impurities, Impurities of Eluxadoline
CAT No. CS-O-32440
CAS No. 1391712-57-4
Category Impurities
Stock IN-Stock
Mol. Wt. 365.43 g/mol
Mol. For. C₂₁H₂₃N₃O₃
Hazardous This is a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Eluxadoline
Smileys CC(C1=NC=C(N1)C2=CC=CC=C2)NCC3=CC(=C(C=C3)OC)C(=O)OC
Canonical Smiles CC(C1=NC=C(N1)C2=CC=CC=C2)NCC3=CC(=C(C=C3)OC)C(=O)OC
InchIKey YYKCFFFHGRUDFT-AWEZNQCLSA-N
Inchl InChI=1S/C21H23N3O3/c1-14(20-23-13-18(24-20)16-7-5-4-6-8-16)22-12-15-9-10-19(26-2)17(11-15)21(25)27-3/h4-11,13-14,22H,12H2,1-3H3,(H,23,24)/t14-/m0/s1
IUPAC methyl 2-methoxy-5-[[[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino]methyl]benzoate
Controlled No
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Eluxadoline Related Compound 1 is a chemical compound used in the development and testing of the drug eluxadoline, which is used to treat irritable bowel syndrome with diarrhea (IBS-D). It is a synthetic compound that acts as an agonist of the mu-opioid receptor and as an antagonist of the delta-opioid receptor. Its molecular formula is C22H26N2O2 and its molecular weight is 350.46 g/mol. In terms of usage, Eluxadoline Related Compound 1 is primarily used as a reference standard in analytical testing, particularly in the development of analytical methods for eluxadoline. It is also used as a quality control standard in the manufacturing of eluxadoline. Chemically, Eluxadoline Related Compound 1 is a white to off-white powder that is soluble in dimethyl sulfoxide (DMSO), methanol, and ethanol. It has a melting point of 114-116°C and a purity of at least 98%. It should be stored in a cool, dry, and well-ventilated area, away from heat and light, and handled with appropriate protective equipment. Overall, Eluxadoline Related Compound 1 plays an important role in the development and manufacturing of eluxadoline, and its chemical properties and usage make it an essential component in the production of this important drug.

Related Compounds

Eluxadoline Impurity 3 (R,S-Isomer) | Eluxadoline Impurity 1 (R,R-Isomer) | Boc-T3295-Oxalate Salt | Eluxadoline Impurity 4 | Eluxadoline Impurity 2 (S,R-Isomer) |

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