Products 1313802-67-3

CAS 1313802-67-3 is the registry number for Setin-1. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

3-[[3-[4-[4-(trifluoromethyl)phenyl]indol-1-yl]phenyl]methylamino]benzoic acid (CAS 1313802-67-3) is a chemical compound with the molecular formula C29H21F3N2O2 and a molecular weight of 486.5 g/mol. IUPAC name: 3-[[3-[4-[4-(trifluoromethyl)phenyl]indol-1-yl]phenyl]methylamino]benzoic acid. InChIKey: XPJOGIGKCTXMJB-UHFFFAOYSA-N.

Identity
Molecular formulaC29H21F3N2O2
Molecular weight486.5 g/mol
IUPAC name3-[[3-[4-[4-(trifluoromethyl)phenyl]indol-1-yl]phenyl]methylamino]benzoic acid
InChIKeyXPJOGIGKCTXMJB-UHFFFAOYSA-N
SMILESC1=CC(=CC(=C1)N2C=CC3=C(C=CC=C32)C4=CC=C(C=C4)C(F)(F)F)CNC5=CC=CC(=C5)C(=O)O

Computed by PubChem (NCBI)

Synonyms: Setin-1, orb1701586, XPJOGIGKCTXMJB-UHFFFAOYSA-N, 3-[3-[4-[4-(Trifluoromethyl)phenyl]-1H-indole-1-yl]benzylamino]benzoic acid, 3-(3-(4-(4-(Trifluoromethyl)phenyl)-1H-indol-1-yl)benzylamino)benzoic acid
Isomers (same molecular formula)
2-(4-methoxyphenyl)-4,5-diphenyl-1-[4-(trifluoromethoxy)phenyl]imidazole C29H21F3N2O2

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