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ScientificNameLabel
Peganones
PHCD compound ID : 67
Chemical Names :
Peganones
Molecular Formula : C11H12N2O2
Molecular Weight : 204.089878
More Details :
Names & Synonyms: 3-ethyl-5-phenyl-imidazolidine-2,4-dione , 3-ethyl-5-phenylimidazolidine-2,4-dione , 3-ethyl-5-phenyl-hydantoin
Smiles: CCN1C(=O)N[C@@H](C1=O)c1ccccc1
InChi : InChI=1S/C11H12N2O2/c1-2-13-10(14)9(12-11(13)15)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,12,15)/t9-/m1/s1
InChi Key : InChIKey=SZQIFWWUIBRPBZ-SECBINFHSA-N
PubChem ID : 3292
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 9.959550
Hydrogen bond donor count : 1 Electric dipole moment : 2.708
XLogP : 0.633 VDW volume : 189.591052
Molecular weight : 204.089878 HOMO-LUMO gap : 9.569000
Herb list :
Refrences & Litretures:
  
3.      Journal:'Pharmacognosy Reviews'      Year:'2013'      Volume:'7'      Page:'199'      DOI:'10.4103/0973-7847.120524'      Title:'Pharmacological and therapeutic effects of Peganum harmala and its main alkaloids'
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