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CAS 411221-53-9

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1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-3-hydroxy-5-isobenzofurancarbonitrile

Description:
1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-3-hydroxy-5-isobenzofurancarbonitrile, with CAS number 411221-53-9, is a synthetic organic compound characterized by its complex structure, which includes a dimethylamino group, a fluorophenyl moiety, and an isobenzofurancarbonitrile framework. This compound typically exhibits properties such as moderate solubility in organic solvents and potential bioactivity, making it of interest in medicinal chemistry and pharmacology. The presence of the dimethylamino group suggests possible interactions with biological targets, while the fluorophenyl group may enhance lipophilicity and metabolic stability. The hydroxyl group contributes to its potential reactivity and solubility in polar solvents. As a nitrile, it may also participate in various chemical reactions, including nucleophilic additions. Overall, this compound's unique structural features may confer specific pharmacological properties, warranting further investigation for therapeutic applications. However, detailed studies on its biological activity, toxicity, and pharmacokinetics would be necessary to fully understand its potential uses.
Formula:C20H21FN2O2
InChI:InChI=1S/C20H21FN2O2/c1-23(2)11-3-10-20(15-5-7-16(21)8-6-15)18-9-4-14(13-22)12-17(18)19(24)25-20/h4-9,12,19,24H,3,10-11H2,1-2H3
InChI key:InChIKey=LJPQJFHBFOOIHE-UHFFFAOYSA-N
SMILES:C(CCN(C)C)C1(C=2C(C(O)O1)=CC(C#N)=CC2)C3=CC=C(F)C=C3
Synonyms:
  • 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-3-hydroxy-5-isobenzofurancarbonitrile
  • 5-Isobenzofurancarbonitrile, 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-3-hydroxy-
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