1021-25-6 | 1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one

Packsize	Purity	Availability	Price	Discounted Price
100mg	97%	in stock	$23.00	$17.00
250mg	97%	in stock	$31.00	$22.00
1g	97%	in stock	$90.00	$63.00
5g	97%	in stock	$334.00	$234.00

Description

• Catalog Number: AA08390
• Chemical Name: 1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one
• CAS Number: 1021-25-6
• Molecular Formula: C13H17N3O
• Molecular Weight: 231.2936
• MDL Number: MFCD00005977
• SMILES: O=C1NCN(C21CCNCC2)c1ccccc1
• NSC Number: 96918

Computed Properties

• Complexity: 293
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 17
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 0.8

Upstream Synthesis Route

1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one, a unique heterocyclic compound, is a versatile reagent widely employed in chemical synthesis. With its spirocyclic framework and functional groups, this compound serves as a valuable building block for the construction of complex organic molecules in the pharmaceutical and agrochemical industries. In particular, its distinct structure offers opportunities for enhancing molecular diversity and tuning physicochemical properties.One of the key applications of 1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one is in the development of novel drug candidates through medicinal chemistry. By incorporating this compound into molecular scaffolds, researchers can explore new chemical space and potentially discover compounds with improved biological activity and pharmacokinetic profiles. Additionally, its spirocyclic moiety can contribute to enhancing the metabolic stability and bioavailability of the resulting compounds, making it a valuable tool in drug discovery efforts.Furthermore, 1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one can be utilized in the synthesis of biologically active molecules, natural product derivatives, and functional materials. Its ability to serve as a structural motif for diverse transformations, including cyclizations, substitutions, and functional group manipulations, makes it a valuable asset for designing and accessing a wide range of compounds with potential applications in various fields of chemistry.Overall, the strategic incorporation of 1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one in chemical synthesis enables the efficient creation of structurally complex and diverse molecules with tailored properties, positioning it as a valuable tool for innovation in drug discovery and materials science.

Literature

• 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