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CAS 330633-81-3

:

2-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}ethanol

Description:
2-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}ethanol, with the CAS number 330633-81-3, is a chemical compound characterized by its complex structure that includes a piperazine ring, a nitro group, and a trifluoromethyl group. This compound typically exhibits properties associated with both basic and aromatic functionalities, making it potentially useful in medicinal chemistry, particularly in the development of pharmaceuticals. The presence of the trifluoromethyl group often enhances lipophilicity and metabolic stability, while the nitro group can serve as a bioisostere for other functional groups in drug design. Additionally, the ethanol moiety contributes to its solubility in polar solvents. The compound's structure suggests potential interactions with biological targets, which may lead to various pharmacological effects. As with many synthetic organic compounds, its safety profile, including toxicity and environmental impact, would need to be assessed through appropriate studies. Overall, this compound represents a class of molecules that may have significant applications in therapeutic contexts.
Formula:C13H16F3N3O3
InChI:InChI=1/C13H16F3N3O3/c14-13(15,16)10-1-2-11(12(9-10)19(21)22)18-5-3-17(4-6-18)7-8-20/h1-2,9,20H,3-8H2
SMILES:c1cc(c(cc1C(F)(F)F)N(=O)=O)N1CCN(CC1)CCO
Synonyms:
  • 1-Piperazineethanol, 4-[2-nitro-4-(trifluoromethyl)phenyl]-
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