CAS 183320-15-2: Ethanol, 2-[[4-[(3-ethynylphenyl)amino]-7-(2-methoxyethoxy)-6-quinazolinyl]oxy]-, 1-acetate

Description: The chemical substance known as "Ethanol, 2-[[4-[(3-ethynylphenyl)amino]-7-(2-methoxyethoxy)-6-quinazolinyl]oxy]-, 1-acetate" with CAS number 183320-15-2 is a complex organic compound characterized by its unique structural features. It contains a quinazoline core, which is a bicyclic structure known for its presence in various biologically active compounds. The presence of an ethynylphenyl group suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals. The methoxyethoxy group may enhance solubility and bioavailability, while the acetate moiety indicates that the compound is likely to be an ester, which can influence its reactivity and stability. This compound may exhibit specific biological activities, potentially acting as an inhibitor or modulator in various biochemical pathways. Its synthesis and characterization would typically involve standard organic chemistry techniques, and its properties would be assessed through methods such as spectroscopy and chromatography. Overall, this compound represents a class of molecules that could be of interest in drug discovery and development.

Formula: C₂₃H₂₃N₃O₅

InChI: InChI=1S/C23H23N3O5/c1-4-17-6-5-7-18(12-17)26-23-19-13-21(31-11-10-29-16(2)27)22(30-9-8-28-3)14-20(19)24-15-25-23/h1,5-7,12-15H,8-11H2,2-3H3,(H,24,25,26)

InChI key: InChIKey=XSMVZQAPXNUGBP-UHFFFAOYSA-N

SMILES: O=C(OCCOC1=CC=2C(=NC=NC2NC=3C=CC=C(C#C)C3)C=C1OCCOC)C

Synonyms:

• 2-((4-((3-Ethynylphenyl)amino)-7-(2-methoxyethoxy)quinazolin-6-yl)oxy)ethyl acetate
• Ethanol, 2-[[4-[(3-ethynylphenyl)amino]-7-(2-methoxyethoxy)-6-quinazolinyl]oxy]-, acetate (ester)
• Demethyl erlotinib acetate
• Ethanol, 2-[[4-[(3-ethynylphenyl)amino]-7-(2-methoxyethoxy)-6-quinazolinyl]oxy]-, 1-acetate

Ethanol, 2-[[4-[(3-ethynylphenyl)amino]-7-(2-methoxyethoxy)-6-quinazolinyl]oxy]-, 1-acetate

CAS: 183320-15-2

• Formula: C₂₃H₂₃N₃O₅
• Color and Shape: Solid
• Molecular weight: 421.4458

Desmethyl erlotinib acetate

CAS: 183320-15-2

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• Formula: C₂₃H₂₃N₃O₅
• Purity: Min. 95%
• Molecular weight: 421.45 g/mol