CAS 477334-02-4

1-(1,3-Benzodioxol-5-yl)-3-[(3-chloro-4-methylphenyl)amino]-1-propanone

Description:

1-(1,3-Benzodioxol-5-yl)-3-[(3-chloro-4-methylphenyl)amino]-1-propanone, with the CAS number 477334-02-4, is a synthetic organic compound characterized by its complex structure, which includes a benzodioxole moiety and an amine group. This compound typically exhibits properties associated with both aromatic and aliphatic systems, contributing to its potential biological activity. It is likely to be a solid at room temperature, with moderate solubility in organic solvents due to its hydrophobic aromatic components. The presence of the chloro and methyl substituents on the phenyl ring may influence its reactivity and interaction with biological targets, making it of interest in medicinal chemistry. Additionally, the compound may exhibit specific pharmacological properties, although detailed studies would be necessary to elucidate its mechanism of action and therapeutic potential. Safety and handling precautions should be observed, as with many synthetic organic compounds, due to potential toxicity or reactivity.

Formula: C₁₇H₁₆ClNO₃

InChI: InChI=1S/C17H16ClNO3/c1-11-2-4-13(9-14(11)18)19-7-6-15(20)12-3-5-16-17(8-12)22-10-21-16/h2-5,8-9,19H,6-7,10H2,1H3

InChI key: InChIKey=JGNJFWFLZCDBDL-UHFFFAOYSA-N

SMILES: C(CCNC1=CC(Cl)=C(C)C=C1)(=O)C=2C=C3C(=CC2)OCO3

Synonyms:

• 1-Propanone, 1-(1,3-benzodioxol-5-yl)-3-[(3-chloro-4-methylphenyl)amino]-
• 1-(1,3-Benzodioxol-5-yl)-3-[(3-chloro-4-methylphenyl)amino]-1-propanone