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(S,S)-BtbbPh-Sabox

  • CAS No. 1428328-51-1

  • Cat. No. CS-0035189
  • Purity≥95%
  • MDL No.MFCD26404519

*For research and further manufacturing use only, not for direct human use.

(S,S)-BtbbPh-Sabox|CS-0035189

Structure of 1428328-51-1

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General Information

  • CAS No. 1428328-51-1
  • Cat. No. CS-0035189
  • Purity ≥95%
  • MDL No. MFCD26404519
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄₁H₄₆N₂O₂
  • Molecular Weight 598.82
  • Synonym(s) 1,3-Bis[4-(tert-butyl)phenyl]-2,2-Bis[(S)-4-phenyl-4,5-dihydro-2-oxazolyl]propane
  • SMILES CC(C)(C)C(C=C1)=CC=C1CC(C2=N[C@@H](C3=CC=CC=C3)CO2)(C4=N[C@@H](C5=CC=CC=C5)CO4)CC6=CC=C(C(C)(C)C)C=C6

Description

(S,S)-BtbbPh-Sabox is a chiral, bench-stable scaffold featuring a rigid biaryl core and a functionalized sulfonamide moiety. This configuration enables precise stereocontrol in asymmetric synthesis, particularly in the construction of complex heterocycles. The molecule integrates seamlessly into catalytic systems requiring defined spatial orientation and enhanced solubility in polar organic solvents.

Application

(S,S)-BtbbPh-Sabox serves as a highly effective chiral ligand in transition-metal-catalyzed asymmetric synthesis, enabling enantioselective C–C and C–heteroatom bond formations. Its robust scaffold offers excellent bench stability, facile purification, and broad functional group tolerance, making it ideal for scalable applications in medicinal chemistry and process development.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   43.18
  • LogP   9.3932
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   8

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