AC1Q4MSX structure

AC1Q4MSX

4-[5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]pyridine

Also Known As: 4-(5-((2-chloro-6-fluorobenzyl)thio)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl)pyridine|4-(5-((2-CL-6-FLUOROBENZYL)SULFANYL)-4-(4-CL-PH)-4H-1,2,4-TRIAZOL-3-YL)PYRIDINE|4-(5-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl)pyridine|4-[5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]pyridine|4-[5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]pyridine|4-{5-[(2-chloro-6-fluorobenzyl)sulfanyl]-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl}pyridine

CAS: 613226-01-0
Molecular Formula C20H13Cl2FN4S
Molecular Weight 430.0222 g/mol
LogP 6.0675
Topological Polar Surface Area 43.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 5
Exact Mass 430.0222
Monoisotopic Mass 430.0222
Heavy Atoms 28
Complexity 1080.9061

Chemical Identifiers

CAS Number 613226-01-0
SMILES C1=CC(=C(C(=C1)Cl)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=NC=C4)F

Product Overview

AC1Q4MSX (CAS 613226-01-0), with molecular formula C20H13Cl2FN4S and molecular weight 430.0222 g/mol. IUPAC: 4-[5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]pyridine.

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