ChemSpider 2D Image | 1-{[1,3-Dimethyl-4-(methylsulfanyl)-1H-imidazol-3-ium-5-yl]methyl}-6-hydroxy-9H-beta-carboline-3-carboxylate | C19H18N4O3S

1-{[1,3-Dimethyl-4-(methylsulfanyl)-1H-imidazol-3-ium-5-yl]methyl}-6-hydroxy-9H-β-carboline-3-carboxylate

  • Molecular FormulaC19H18N4O3S
  • Average mass382.436 Da
  • Monoisotopic mass382.109955 Da
  • ChemSpider ID23326706

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-{[1,3-Dimethyl-4-(methylsulfanyl)-1H-imidazol-3-ium-5-yl]methyl}-6-hydroxy-9H-β-carbolin-3-carboxylat [German] [ACD/IUPAC Name]
1-{[1,3-Dimethyl-4-(methylsulfanyl)-1H-imidazol-3-ium-5-yl]methyl}-6-hydroxy-9H-β-carboline-3-carboxylate [ACD/IUPAC Name]
1-{[1,3-Diméthyl-4-(méthylsulfanyl)-1H-imidazol-3-ium-5-yl]méthyl}-6-hydroxy-9H-β-carboline-3-carboxylate [French] [ACD/IUPAC Name]
1H-Imidazolium, 5-[(3-carboxy-6-hydroxy-9H-pyrido[3,4-b]indol-1-yl)methyl]-1,3-dimethyl-4-(methylthio)-, inner salt [ACD/Index Name]
dragmacidonamine A

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
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Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 123 Å2
Polarizability:
Surface Tension:
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