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5-[(5-Benzyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-ethylbenzoyl)-3-methylpiperazin-1-yl]pentan-1-one

Base Information
  • Chemical Name:5-[(5-Benzyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-ethylbenzoyl)-3-methylpiperazin-1-yl]pentan-1-one
  • CAS No.:5887-99-0
  • Molecular Formula:C34H39N5O2S
  • Molecular Weight:581.7708
  • Hs Code.:
  • DSSTox Substance ID:DTXSID40409694
5-[(5-Benzyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-ethylbenzoyl)-3-methylpiperazin-1-yl]pentan-1-one

Synonyms:5887-99-0;DTXSID40409694;5-[(5-Benzyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-ethylbenzoyl)-3-methylpiperazin-1-yl]pentan-1-one

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Chemical Property of 5-[(5-Benzyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-ethylbenzoyl)-3-methylpiperazin-1-yl]pentan-1-one
Chemical Property:
  • Vapor Pressure:3.38E-26mmHg at 25°C 
  • Boiling Point:808.6°Cat760mmHg 
  • Flash Point:442.8°C 
  • Density:1.19g/cm3 
  • XLogP3:6.2
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:5
  • Rotatable Bond Count:11
  • Exact Mass:581.28244668
  • Heavy Atom Count:42
  • Complexity:840
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CCC1=CC=C(C=C1)C(=O)N2CCN(CC2C)C(=O)CCCCSC3=NN=C(N3C4=CC=CC=C4)CC5=CC=CC=C5
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