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2,4,6-Triphenylaniline
PHCD compound ID : 2986
Chemical Names :
2,4,6-Triphenylaniline
Molecular Formula : C24H19N1
Molecular Weight : 321.15175
More Details :
Names & Synonyms: 2,4,6-triphenylaniline , (2,4,6-triphenylphenyl)amine
Smiles: Nc1c(cc(cc1c1ccccc1)c1ccccc1)c1ccccc1
InChi : InChI=1S/C24H19N/c25-24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20/h1-17H,25H2
InChi Key : InChIKey=AGWKGKUGJDMKMT-UHFFFAOYSA-N
PubChem ID : 629425
Rotatable bond count : 3 Rule of five : 1
Hydrogen bond acceptor count : 1 Ionization potential : 8.316771
Hydrogen bond donor count : 1 Electric dipole moment : 1.980
XLogP : 5.621 VDW volume : 309.993511
Molecular weight : 321.15175 HOMO-LUMO gap : 8.234000
Herb list :
Refrences & Litretures:
  
377.      Journal:'Pharmaceutical Biology'      Year:'2011'      Volume:'49'      Page:'756'      DOI:'10.3109/13880209.2010.547206'      Title:'Chemical constituents and bioactivities of the liposoluble fraction from different medicinal parts of Crocus sativus'
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