100615-14-3 | 1-Cyclohexyl-3H-1,3-benzodiazol-2-one

Packsize	Purity	Availability	Price	Discounted Price
250mg	98%	in stock	$105.00	$74.00
1g	98%	in stock	$201.00	$141.00
5g	98%	in stock	$572.00	$400.00
10g	98%	in stock	$1,038.00	$727.00

Description

• Catalog Number: AE24946
• Chemical Name: 1-Cyclohexyl-3H-1,3-benzodiazol-2-one
• CAS Number: 100615-14-3
• Molecular Formula: C13H16N2O
• Molecular Weight: 216.2789
• MDL Number: MFCD02271220
• SMILES: O=c1[nH]c2c(n1C1CCCCC1)cccc2

Computed Properties

• Complexity: 273
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 1
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 3.2

Upstream Synthesis Route

1-Cyclohexyl-3H-1,3-benzodiazol-2-one is a versatile compound that finds wide application in chemical synthesis. This compound serves as a valuable building block in the synthesis of various organic molecules due to its unique structural properties. In chemical synthesis, 1-Cyclohexyl-3H-1,3-benzodiazol-2-one is frequently used as a starting material for the preparation of heterocyclic compounds, pharmaceuticals, agrochemicals, and functional materials. Its cyclohexyl and benzodiazole moieties provide a scaffold that enables chemists to introduce diverse functional groups and modify its properties to suit specific applications.One of the key applications of 1-Cyclohexyl-3H-1,3-benzodiazol-2-one is in the construction of biologically active molecules such as benzodiazepines, which are widely used in the pharmaceutical industry for their sedative, anxiolytic, and muscle relaxant properties. Additionally, this compound can serve as a precursor for the synthesis of fluorescent dyes, liquid crystals, and other specialty chemicals.Overall, the versatility of 1-Cyclohexyl-3H-1,3-benzodiazol-2-one in chemical synthesis makes it a valuable tool for organic chemists seeking to design and create novel compounds with a diverse range of applications.

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