AC1NSIK9 structure

AC1NSIK9

methyl 2-[[3-(3-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]propanoate

Also Known As: NCGC00082146-02|NCGC00164699-01|AB00433351-05|SR-01000135638-1|F0676-0464|methyl 2-((3-(3-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)propanoate|methyl 2-[[3-(3-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]propanoate|methyl 2-{[3-(3-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}propanoate

CAS: 852375-22-5
Molecular Formula C15H13FN4O2S
Molecular Weight 332.0743 g/mol
LogP 2.584
Topological Polar Surface Area 69.38 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 332.0743
Monoisotopic Mass 332.0743
Heavy Atoms 23
Complexity 867.5591

Chemical Identifiers

CAS Number 852375-22-5
SMILES CC(C(=O)OC)SC1=NN2C(=NN=C2C3=CC(=CC=C3)F)C=C1

Product Overview

AC1NSIK9 (CAS 852375-22-5), with molecular formula C15H13FN4O2S and molecular weight 332.0743 g/mol. IUPAC: methyl 2-[[3-(3-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]propanoate.

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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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