CAS 870692-98-1

3-[4-(1-Methylethyl)phenyl]-2,4(1H,3H)-quinazolinedione

Description:

3-[4-(1-Methylethyl)phenyl]-2,4(1H,3H)-quinazolinedione, identified by its CAS number 870692-98-1, is a synthetic organic compound characterized by its quinazoline core structure, which is a bicyclic compound containing a benzene ring fused to a pyrimidine ring. This compound features a substituent group, specifically a 4-(1-methylethyl)phenyl group, which contributes to its unique chemical properties and potential biological activity. Quinazolinediones are known for their diverse applications in medicinal chemistry, often exhibiting pharmacological properties such as anti-inflammatory, anticancer, or antimicrobial activities. The presence of the isopropyl group (1-methylethyl) enhances the lipophilicity of the molecule, potentially influencing its solubility and permeability in biological systems. Additionally, the compound's structure may allow for interactions with various biological targets, making it a subject of interest in drug discovery and development. Overall, this compound exemplifies the complexity and utility of heterocyclic compounds in pharmaceutical research.

Formula: C₁₇H₁₆N₂O₂

InChI: InChI=1S/C17H16N2O2/c1-11(2)12-7-9-13(10-8-12)19-16(20)14-5-3-4-6-15(14)18-17(19)21/h3-11H,1-2H3,(H,18,21)

InChI key: InChIKey=ZUAKYEINYRAVOG-UHFFFAOYSA-N

SMILES: O=C1N(C(=O)NC=2C1=CC=CC2)C3=CC=C(C(C)C)C=C3

Synonyms:

• 3-[4-(1-Methylethyl)phenyl]-2,4(1H,3H)-quinazolinedione
• 2-Hydroxy-3-[4-(propan-2-yl)phenyl]-3,4-dihydroquinazolin-4-one
• 2,4(1H,3H)-Quinazolinedione, 3-[4-(1-methylethyl)phenyl]-

2-Hydroxy-3-[4-(propan-2-yl)phenyl]-3,4-dihydroquinazolin-4-one

Controlled Product

CAS: 870692-98-1

Versatile small molecule scaffold

Formula: C₁₇H₁₆N₂O₂

Purity: Min. 95%

Molecular weight: 280.32 g/mol

Ref: 3D-VJB69298