Found 25 results

Search term: MF = 'C_{19}H_{16}N_{8}OS'
ChemSpider 2D Image | 4,7-Dimethyl-1-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one | C19H16N8OS

4,7-Dimethyl-1-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one

  • Molecular FormulaC19H16N8OS
  • Average mass404.448 Da
  • Monoisotopic mass404.116791 Da
  • ChemSpider ID30508710

More details:

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

[1,2,4]Triazolo[4,3-a]quinazolin-5(4H)-one, 4,7-dimethyl-1-[[(1-phenyl-1H-tetrazol-5-yl)thio]methyl]- [ACD/Index Name]
4,7-Dimethyl-1-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}[1,2,4]triazolo[4,3-a]chinazolin-5(4H)-on [German] [ACD/IUPAC Name]
4,7-Dimethyl-1-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one [ACD/IUPAC Name]
4,7-Diméthyl-1-{[(1-phényl-1H-tétrazol-5-yl)sulfanyl]méthyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 725.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 105.9±3.0 kJ/mol
Flash Point: 392.4±35.7 °C
Index of Refraction: 1.809
Molar Refractivity: 112.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.13
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 59.80
ACD/KOC (pH 5.5): 650.66
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 59.81
ACD/KOC (pH 7.4): 650.74
Polar Surface Area: 120 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 69.4±7.0 dyne/cm
Molar Volume: 261.7±7.0 cm3

Click to predict properties on the Chemicalize site


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