79508-09-1 | Methyl 3-(4-chlorophenyl)-1h-pyrazole-5-carboxylate

Packsize	Purity	Availability	Price	Discounted Price
1g	96%	in stock	$106.00	$75.00
5g	96%	in stock	$387.00	$271.00

Description

• Catalog Number: AI56520
• Chemical Name: Methyl 3-(4-chlorophenyl)-1h-pyrazole-5-carboxylate
• CAS Number: 79508-09-1
• Molecular Formula: C11H9ClN2O2
• Molecular Weight: 236.6544
• MDL Number: MFCD07778088
• SMILES: COC(=O)c1cc([nH]n1)c1ccc(cc1)Cl

Computed Properties

• Complexity: 254
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 2.7

Literature

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

  Bioorganic & medicinal chemistry letters 20101101

• 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