122794-99-4 | Ethyl 6-bromo-4-hydroxyquinoline-3-carboxylate

Packsize	Purity	Availability	Price	Discounted Price
250mg	95%	in stock	$8.00	$5.00
1g	95%	in stock	$9.00	$6.00
5g	95%	in stock	$40.00	$28.00
10g	95%	in stock	$76.00	$53.00
25g	95%	in stock	$121.00	$85.00
100g	95%	in stock	$386.00	$270.00
500g	95%	in stock	$1,317.00	$922.00

Description

• Catalog Number: AA25065
• Chemical Name: Ethyl 6-bromo-4-hydroxyquinoline-3-carboxylate
• CAS Number: 122794-99-4
• Molecular Formula: C12H10BrNO3
• Molecular Weight: 296.1167
• MDL Number: MFCD00173362
• SMILES: CCOC(=O)c1cnc2c(c1O)cc(cc2)Br

Computed Properties

• Complexity: 367
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 17
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 2.7

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