26893-12-9 | Ethyl 4-hydroxy-6-(trifluoromethyl)quinoline-3-carboxylate

Packsize	Purity	Availability	Price	Discounted Price
1g	96%	in stock	$34.00	$24.00
5g	96%	in stock	$95.00	$67.00
10g	96%	in stock	$179.00	$125.00
25g	96%	in stock	$420.00	$294.00
100g	96%	in stock	$1,490.00	$1,043.00

Description

• Catalog Number: AB73856
• Chemical Name: Ethyl 4-hydroxy-6-(trifluoromethyl)quinoline-3-carboxylate
• CAS Number: 26893-12-9
• Molecular Formula: C13H10F3NO3
• Molecular Weight: 285.2186
• MDL Number: MFCD00173369
• SMILES: CCOC(=O)c1cnc2c(c1O)cc(cc2)C(F)(F)F

Computed Properties

• Complexity: 445
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 20
• Hydrogen Bond Acceptor Count: 7
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 2.9

Literature

• 4-quinolone derivatives: high-affinity ligands at the benzodiazepine site of brain GABA A receptors. synthesis, pharmacology, and pharmacophore modeling.

  Journal of medicinal chemistry 20060420