AC1NQORT structure

AC1NQORT

8a-methyl-5-oxo-6-[[2-(trifluoromethyl)quinolin-6-yl]methyl]-3,6,7,8-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid

Also Known As: 8a-methyl-5-oxo-6-[[2-(trifluoromethyl)quinolin-6-yl]methyl]-3,6,7,8-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid|8a-Methyl-5-oxo-6-{[2-(trifluoromethyl)quinolin-6-yl]methyl}hexahydro-5H-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid

CAS: 7236-40-0
Molecular Formula C20H19F3N2O3S
Molecular Weight 424.10684 g/mol
LogP 3.9509
Topological Polar Surface Area 70.5 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 3
Exact Mass 424.10684
Monoisotopic Mass 424.10684
Heavy Atoms 29
Complexity 996.5855

Chemical Identifiers

CAS Number 7236-40-0
SMILES CC12CCC(C(=O)N1C(CS2)C(=O)O)CC3=CC4=C(C=C3)N=C(C=C4)C(F)(F)F

Product Overview

AC1NQORT (CAS 7236-40-0), with molecular formula C20H19F3N2O3S and molecular weight 424.10684 g/mol. IUPAC: 8a-methyl-5-oxo-6-[[2-(trifluoromethyl)quinolin-6-yl]methyl]-3,6,7,8-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid.

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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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