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CS-W001157 4
Total: USD 88.00

(1S,2R)-Bedaquiline

  • CAS No. 857086-93-2

  • Cat. No. CS-Z0004
  • Purity≥98%
  • MDL No.MFCD28559416

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

(1S,2R)-Bedaquiline|CS-Z0004

Structure of 857086-93-2

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General Information

  • CAS No. 857086-93-2
  • Cat. No. CS-Z0004
  • Purity ≥98%
  • MDL No. MFCD28559416
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃₂H₃₁BrN₂O₂
  • Molecular Weight 555.50
  • Synonym(s) (1S,2R)-TMC207; (1S,2R)-R207910
  • SMILES BrC1=CC=C(N=C(OC)C([C@@H]([C@@](CCN(C)C)(O)C2=CC=CC3=C2C=CC=C3)C4=CC=CC=C4)=C5)C5=C1

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   45.59
  • LogP   7.1305
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   8

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