14441-90-8 | 5-Phenylisoxazole-3-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	95%	in stock	$17.00	$12.00
5g	97%	in stock	$26.00	$18.00
10g	97%	in stock	$50.00	$35.00
25g	97%	in stock	$123.00	$86.00

Description

• Catalog Number: AA71732
• Chemical Name: 5-Phenylisoxazole-3-carboxylic acid
• CAS Number: 14441-90-8
• Molecular Formula: C10H7NO3
• Molecular Weight: 189.1675
• MDL Number: MFCD00464221
• SMILES: OC(=O)c1noc(c1)c1ccccc1

Computed Properties

• Complexity: 213
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 2.4

Literature

• AutoClickChem: click chemistry in silico.

  PLoS computational biology 20120301

• Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

  Bioorganic & medicinal chemistry letters 20101101

• Synthesis of some 5-phenylisoxazole-3-carboxylic acid derivatives as potent xanthine oxidase inhibitors.

  European journal of medicinal chemistry 20100601

• Rational design of 5-phenyl-3-isoxazolecarboxylic acid ethyl esters as growth inhibitors of Mycobacterium tuberculosis. a potent and selective series for further drug development.

  Journal of medicinal chemistry 20100128

• Microsphere-based protease assays and screening application for lethal factor and factor Xa.

  Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

• Design of novel bioisosteres of beta-diketo acid inhibitors of HIV-1 integrase.

  Antiviral chemistry & chemotherapy 20050101