AC1OKHQR structure

AC1OKHQR

2-[4-(4-ethoxyphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide

Also Known As: F2696-0778|2-{[4-(4-ethoxyphenyl)-3-oxo-3,4-dihydropyrazin-2-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide|2-((4-(4-ethoxyphenyl)-3-oxo-3,4-dihydropyrazin-2-yl)thio)-N-(4-fluorobenzyl)acetamide|2-[4-(4-ethoxyphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide

CAS: 899759-56-9
Molecular Formula C21H20FN3O3S
Molecular Weight 413.12094 g/mol
LogP 3.1788
Topological Polar Surface Area 73.22 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 8
Exact Mass 413.12094
Monoisotopic Mass 413.12094
Heavy Atoms 29
Complexity 1020.5914

Chemical Identifiers

CAS Number 899759-56-9
SMILES CCOC1=CC=C(C=C1)N2C=CN=C(C2=O)SCC(=O)NCC3=CC=C(C=C3)F

Product Overview

AC1OKHQR (CAS 899759-56-9), with molecular formula C21H20FN3O3S and molecular weight 413.12094 g/mol. IUPAC: 2-[4-(4-ethoxyphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide.

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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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