CAS 1289384-69-5

1-(1,1-Dimethylethyl) 4-[(2-chloro-5-thiazolyl)methyl]-1,3-piperazinedicarboxylate

Description:

1-(1,1-Dimethylethyl) 4-[(2-chloro-5-thiazolyl)methyl]-1,3-piperazinedicarboxylate is a synthetic organic compound characterized by its complex structure, which includes a piperazine ring, carboxylate groups, and a thiazole moiety. The presence of the 1,1-dimethylethyl group contributes to its steric bulk, potentially influencing its reactivity and solubility. The thiazole ring, containing sulfur and nitrogen, is known for its biological activity, often serving as a pharmacophore in medicinal chemistry. This compound may exhibit properties such as moderate to high lipophilicity due to the bulky substituents, which can affect its bioavailability and interaction with biological targets. Additionally, the chlorine atom on the thiazole ring may enhance its reactivity and influence its pharmacological profile. Overall, this compound's unique structural features suggest potential applications in drug development, particularly in areas targeting specific biological pathways or conditions. However, detailed studies would be necessary to fully elucidate its properties and potential uses.

Formula: C₁₄H₂₀ClN₃O₄S

InChI: InChI=1S/C14H20ClN3O4S/c1-14(2,3)22-13(21)18-5-4-17(10(8-18)11(19)20)7-9-6-16-12(15)23-9/h6,10H,4-5,7-8H2,1-3H3,(H,19,20)

InChI key: InChIKey=IHUVORYVZKTCEN-UHFFFAOYSA-N

SMILES: C(N1C(C(O)=O)CN(C(OC(C)(C)C)=O)CC1)C2=CN=C(Cl)S2

Synonyms:

• 1,3-Piperazinedicarboxylic acid, 4-[(2-chloro-5-thiazolyl)methyl]-, 1-(1,1-dimethylethyl) ester
• 1-(1,1-Dimethylethyl) 4-[(2-chloro-5-thiazolyl)methyl]-1,3-piperazinedicarboxylate