ChemSpider 2D Image | 6-[3,5-Dichloro-2-(propionyloxy)phenyl]-3-(methylsulfanyl)-7-propionyl-6,7-dihydro[1,2,4]triazino[1,6-c]quinazolin-5-ium-1-olate | C23H20Cl2N4O4S

6-[3,5-Dichloro-2-(propionyloxy)phenyl]-3-(methylsulfanyl)-7-propionyl-6,7-dihydro[1,2,4]triazino[1,6-c]quinazolin-5-ium-1-olate

  • Molecular FormulaC23H20Cl2N4O4S
  • Average mass519.400 Da
  • Monoisotopic mass518.058228 Da
  • ChemSpider ID30662720

More details:

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

[1,2,4]Triazino[1,6-c]quinazolin-5-ium, 6-[3,5-dichloro-2-(1-oxopropoxy)phenyl]-6,7-dihydro-1-hydroxy-3-(methylthio)-7-(1-oxopropyl)-, inner salt [ACD/Index Name]
6-[3,5-Dichlor-2-(propionyloxy)phenyl]-3-(methylsulfanyl)-7-propionyl-6,7-dihydro[1,2,4]triazino[1,6-c]chinazolin-5-ium-1-olat [German] [ACD/IUPAC Name]
6-[3,5-Dichloro-2-(propionyloxy)phenyl]-3-(methylsulfanyl)-7-propionyl-6,7-dihydro[1,2,4]triazino[1,6-c]quinazolin-5-ium-1-olate [ACD/IUPAC Name]
6-[3,5-Dichloro-2-(propionyloxy)phényl]-3-(méthylsulfanyl)-7-propionyl-6,7-dihydro[1,2,4]triazino[1,6-c]quinazolin-5-ium-1-olate [French] [ACD/IUPAC Name]
6-(3,5-dichloro-2-(propionyloxy)phenyl)-3-(methylthio)-7-propionyl-6,7-dihydro-[1,2,4]triazino[1,6-c]quinazolin-5-ium-1-olate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
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Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#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: 125 Å2
Polarizability:
Surface Tension:
Molar Volume:

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