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CAS 1221274-36-7

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1,1-Dimethylethyl (3S)-3-phenyl-1-piperazinecarboxylate

Description:
1,1-Dimethylethyl (3S)-3-phenyl-1-piperazinecarboxylate is a chemical compound characterized by its piperazine core, which is a six-membered ring containing two nitrogen atoms. The presence of the 1,1-dimethylethyl group, also known as a tert-butyl group, contributes to its steric bulk, potentially influencing its reactivity and interaction with biological targets. The phenyl group attached to the piperazine adds aromatic characteristics, which can enhance lipophilicity and affect the compound's solubility in organic solvents. This compound may exhibit pharmacological properties due to its structural features, making it of interest in medicinal chemistry. Its specific stereochemistry, indicated by the (3S) designation, suggests that it may have distinct biological activity based on its three-dimensional arrangement. The CAS number 1221274-36-7 provides a unique identifier for this compound, facilitating its identification in chemical databases and literature. Overall, the combination of these structural elements suggests potential applications in drug development and research.
Formula:C15H22N2O2
InChI:InChI=1S/C15H22N2O2/c1-15(2,3)19-14(18)17-10-9-16-13(11-17)12-7-5-4-6-8-12/h4-8,13,16H,9-11H2,1-3H3/t13-/m1/s1
InChI key:InChIKey=HRRFJZULVYGVNJ-CYBMUJFWSA-N
SMILES:C(OC(C)(C)C)(=O)N1C[C@@H](NCC1)C2=CC=CC=C2
Synonyms:
  • (S)-1-Boc-3-Phenylpiperazine
  • 1-Piperazinecarboxylic acid, 3-phenyl-, 1,1-dimethylethyl ester, (3S)-
  • 1,1-Dimethylethyl (3S)-3-phenyl-1-piperazinecarboxylate
  • tert-Butyl(S)-3-phenylpiperazine-1-carboxylate
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