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2-amino-4-(2,3-dichlorophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile

CAS 329716-18-9Formula C16H10Cl2N2O3MW 349.2PubChem 2828681

This compound is a complex organic molecule featuring a pyranopyran core, an amino group, a nitrile group, and a dichlorophenyl substituent. It falls into the 'druglike_bioactive_like' structural bucket, suggesting potential interest in medicinal chemistry or drug discovery research.

Loading RDKit molecule structure...
InChIKey: AQJQVFINWMIQMX-UHFFFAOYSA-NC16H10Cl2N2O3 | MW 349.2

Chemical Identity

Molecular Formula

C16H10Cl2N2O3

Molecular Weight

349.2 g/mol

Exact Mass

348.006848

PubChem CID

2828681

IUPAC Name

2-amino-4-(2,3-dichlorophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile

SMILES String

Cc1cc2c(c(=O)o1)C(c1cccc(Cl)c1Cl)C(C#N)=C(N)O2

Names & Synonyms

2-amino-4-(2,3-dichlorophenyl)-7-methyl-5-oxo-4H,5H-pyrano[3,2-c]pyran-3-carbonitrileOprea1_394469Oprea1_610706AG-205/370220252-amino-4-(2,3-dichlorophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonit rile
Show all synonyms
2-amino-4-(2,3-dichlorophenyl)-7-methyl-5-oxo-4,5-dihydropyrano[4,3-b]pyran-3-carbonitrile
External Identifiers
STK058801AKOS000675566AKOS016340514SS-0822ST071118CS-0320365AB00074105-01SR-01000513895SR-01000513895-1

Catalog Overview

2-amino-4-(2,3-dichlorophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile is a synthetic organic compound with the molecular formula C16H10Cl2N2O3 and a molecular weight of 349.20 g/mol. Its structure is characterized by a fused pyranopyran ring system, substituted with an amino group, a nitrile group, a methyl group, and a 2,3-dichlorophenyl moiety. This chemical structure places it within the class of compounds often explored in medicinal chemistry for their potential biological activities. It is typically supplied for research and development purposes.

Use Context

  • Research chemical sourcing
  • Custom synthesis and catalog availability review
  • COA, SDS, pricing, and fulfillment workflow

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White to off-white crystalline powder

Physical State

Solid

Melting Point

220.0 °C

Boiling Point

500.0 °C

Density

1.45 g/cm³

Water Solubility

Slightly soluble to insoluble

Flash Point

280.0 °C

Applications / Classifications

Research intermediateCustom synthesis building block

Biological Target Reference

No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.

Preliminary Safety-Style Reference

Preliminary

Preliminary safety-style information for reference only. Not a supplier SDS.

Handling and Storage
  • Handle with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or a fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for comprehensive safety information before use.

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