Products 1643757-72-5

CAS 1643757-72-5 appears in our catalog under these names: Fosnetupitant chloride monohydrochloride, Fosnetupitant (chloride monohydrochloride ), 99%, 99%, Fosnetupitant (chloride monohydrochloride ), 99.70%. Offered by: GLPBio, Chemat, MedChemExpress. Available pack sizes: 5mg, 1mg, 25 mg, 5 mg, 1 mg, 10 mg, 10mM/1mL, 100 mg.

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

[4-[5-[[2-[3,5-bis(trifluoromethyl)phenyl]-2-methylpropanoyl]-methylamino]-4-(2-methylphenyl)-2-pyridinyl]-1-methylpiperazin-1-ium-1-yl]methyl dihydrogen phosphate;chloride;hydrochloride (CAS 1643757-72-5) is a chemical compound with the molecular formula C31H37Cl2F6N4O5P and a molecular weight of 761.5 g/mol. IUPAC name: [4-[5-[[2-[3,5-bis(trifluoromethyl)phenyl]-2-methylpropanoyl]-methylamino]-4-(2-methylphenyl)-2-pyridinyl]-1-methylpiperazin-1-ium-1-yl]methyl dihydrogen phosphate;chloride;hydrochloride. InChIKey: LBTQUZNIWCWBNN-UHFFFAOYSA-N.

Identity
Molecular formulaC31H37Cl2F6N4O5P
Molecular weight761.5 g/mol
IUPAC name[4-[5-[[2-[3,5-bis(trifluoromethyl)phenyl]-2-methylpropanoyl]-methylamino]-4-(2-methylphenyl)-2-pyridinyl]-1-methylpiperazin-1-ium-1-yl]methyl dihydrogen phosphate;chloride;hydrochloride
InChIKeyLBTQUZNIWCWBNN-UHFFFAOYSA-N
SMILESCC1=CC=CC=C1C2=CC(=NC=C2N(C)C(=O)C(C)(C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N4CC[N+](CC4)(C)COP(=O)(O)O.Cl.[Cl-]

Computed by PubChem (NCBI)