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CAS 769944-52-7

:

1,4-Bis(1,1-dimethylethyl) (2R)-2-(4-chlorophenyl)-1,4-piperazinedicarboxylate

Description:
1,4-Bis(1,1-dimethylethyl) (2R)-2-(4-chlorophenyl)-1,4-piperazinedicarboxylate, identified by its CAS number 769944-52-7, is a chemical compound characterized by its piperazine core, which is a six-membered ring containing two nitrogen atoms. This compound features two carboxylate ester groups, contributing to its potential solubility and reactivity. The presence of the 4-chlorophenyl group introduces a halogen substituent, which can influence the compound's biological activity and lipophilicity. The two tert-butyl groups (1,1-dimethylethyl) enhance steric hindrance, potentially affecting the compound's interaction with biological targets. This structure suggests that it may exhibit pharmacological properties, making it of interest in medicinal chemistry. The compound's stability, solubility, and reactivity can be influenced by its functional groups and overall molecular architecture. As with many piperazine derivatives, it may be investigated for various applications, including as a pharmaceutical agent or in agrochemical formulations. However, specific biological activity and safety profiles would require further empirical studies.
Formula:C20H29ClN2O4
InChI:InChI=1S/C20H29ClN2O4/c1-19(2,3)26-17(24)22-11-12-23(18(25)27-20(4,5)6)16(13-22)14-7-9-15(21)10-8-14/h7-10,16H,11-13H2,1-6H3/t16-/m0/s1
InChI key:InChIKey=XCWWVMIKMXDYJM-INIZCTEOSA-N
SMILES:C(OC(C)(C)C)(=O)N1[C@@H](CN(C(OC(C)(C)C)=O)CC1)C2=CC=C(Cl)C=C2
Synonyms:
  • 1,4-Piperazinedicarboxylic acid, 2-(4-chlorophenyl)-, 1,4-bis(1,1-dimethylethyl) ester, (2R)-
  • (R)-1,4-Di(tert-butoxycarbonyl)-2-(4-chlorophenyl)piperazine
  • 1,4-Piperazinedicarboxylic acid, 2-(4-chlorophenyl)-, bis(1,1-dimethylethyl) ester, (2R)-
  • 1,4-Bis(1,1-dimethylethyl) (2R)-2-(4-chlorophenyl)-1,4-piperazinedicarboxylate
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