AC1N6FVI structure

AC1N6FVI

3-[(2-chlorophenyl)methylsulfanyl]-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-1,2,4-triazole

Also Known As: 3-((2-chlorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole|3-[(2-chlorobenzyl)sulfanyl]-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole|3-[(2-chlorophenyl)methylsulfanyl]-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-1,2,4-triazole|3-[(2-chlorophenyl)methylthio]-5-(2-fluorophenyl)-4-(2-furylmethyl)-1,2,4-tria zole|3-{[(2-chlorophenyl)methyl]sulfanyl}-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole

CAS: 861111-32-2
Molecular Formula C20H15ClFN3OS
Molecular Weight 399.06085 g/mol
LogP 5.6712
Topological Polar Surface Area 43.85 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 6
Exact Mass 399.06085
Monoisotopic Mass 399.06085
Heavy Atoms 27
Complexity 1049.0836

Chemical Identifiers

CAS Number 861111-32-2
SMILES C1=CC=C(C(=C1)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=C4F)Cl

Product Overview

AC1N6FVI (CAS 861111-32-2), with molecular formula C20H15ClFN3OS and molecular weight 399.06085 g/mol. IUPAC: 3-[(2-chlorophenyl)methylsulfanyl]-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-1,2,4-triazole.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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