Products 2677689-72-2

CAS 2677689-72-2 is the registry number for FXR/TGR5 agonist 1, 98.03%. Offered by: MedChemExpress. Available pack sizes: 10 mg, 5 mg, 1 mg.

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

N-(3-chloro-5-methoxyphenyl)-N-[[4-(3-cyano-4-methoxyphenyl)-1-bicyclo[2.2.2]octanyl]methyl]-3-methylpyridine-4-carboxamide (CAS 2677689-72-2) is a chemical compound with the molecular formula C31H32ClN3O3 and a molecular weight of 530.1 g/mol. IUPAC name: N-(3-chloro-5-methoxyphenyl)-N-[[4-(3-cyano-4-methoxyphenyl)-1-bicyclo[2.2.2]octanyl]methyl]-3-methylpyridine-4-carboxamide. InChIKey: JTGBSPOXKVOUHU-UHFFFAOYSA-N.

Identity
Molecular formulaC31H32ClN3O3
Molecular weight530.1 g/mol
IUPAC nameN-(3-chloro-5-methoxyphenyl)-N-[[4-(3-cyano-4-methoxyphenyl)-1-bicyclo[2.2.2]octanyl]methyl]-3-methylpyridine-4-carboxamide
InChIKeyJTGBSPOXKVOUHU-UHFFFAOYSA-N
SMILESCC1=C(C=CN=C1)C(=O)N(CC23CCC(CC2)(CC3)C4=CC(=C(C=C4)OC)C#N)C5=CC(=CC(=C5)Cl)OC

Computed by PubChem (NCBI)