691363-11-8 | 1-Cyclohexyl-1,2,3-benzotriazole-5-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$105.00	$74.00
5g	98%	in stock	$297.00	$208.00
25g	98%	in stock	$758.00	$531.00

Description

• Catalog Number: AH21587
• Chemical Name: 1-Cyclohexyl-1,2,3-benzotriazole-5-carboxylic acid
• CAS Number: 691363-11-8
• Molecular Formula: C13H15N3O2
• Molecular Weight: 245.2771
• MDL Number: MFCD06589795
• SMILES: OC(=O)c1ccc2c(c1)nnn2C1CCCCC1

Computed Properties

• Complexity: 317
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 18
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 2.6

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

• 1-Alkyl-benzotriazole-5-carboxylic acids are highly selective agonists of the human orphan G-protein-coupled receptor GPR109b.

  Journal of medicinal chemistry 20060223