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CAS 898782-53-1

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Ethyl 4-[4-(4-thiomorpholinylmethyl)benzoyl]benzoate

Description:
Ethyl 4-[4-(4-thiomorpholinylmethyl)benzoyl]benzoate, identified by its CAS number 898782-53-1, is a synthetic organic compound characterized by its complex molecular structure. It features an ethyl ester functional group, which contributes to its solubility in organic solvents. The presence of a thiomorpholine moiety indicates potential for unique reactivity and biological activity, as thiomorpholines are known for their role in medicinal chemistry. The compound also contains aromatic benzoyl groups, which can enhance its stability and influence its interaction with biological targets. Typically, such compounds may exhibit properties like moderate to high lipophilicity, making them suitable for various applications in pharmaceuticals, particularly in drug design and development. Additionally, the presence of multiple functional groups suggests potential for diverse chemical reactivity, including esterification and nucleophilic substitution. Overall, the characteristics of this compound make it a subject of interest in research, particularly in the fields of medicinal chemistry and material science.
Formula:C21H23NO3S
InChI:InChI=1S/C21H23NO3S/c1-2-25-21(24)19-9-7-18(8-10-19)20(23)17-5-3-16(4-6-17)15-22-11-13-26-14-12-22/h3-10H,2,11-15H2,1H3
InChI key:InChIKey=PRIGICDPPNSPBG-UHFFFAOYSA-N
SMILES:C(=O)(C1=CC=C(C(OCC)=O)C=C1)C2=CC=C(CN3CCSCC3)C=C2
Synonyms:
  • Ethyl 4-[4-(4-thiomorpholinylmethyl)benzoyl]benzoate
  • Benzoic acid, 4-[4-(4-thiomorpholinylmethyl)benzoyl]-, ethyl ester
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