ChemSpider 2D Image | 6-(1-Acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione | C30H24N6O4S

6-(1-Acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione

  • Molecular FormulaC30H24N6O4S
  • Average mass564.614 Da
  • Monoisotopic mass564.157959 Da
  • ChemSpider ID4056268

More details:

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

6-(1-Acetyl-2-oxo-1,2-dihydro-3H-indol-3-yliden)-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazin-2,7(1H,6H)-dion [German] [ACD/IUPAC Name]
6-(1-Acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione [ACD/IUPAC Name]
6-(1-Acétyl-2-oxo-1,2-dihydro-3H-indol-3-ylidène)-1,3-diméthyl-3a,9a-diphényl-3,3a,9,9a-tétrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione [French] [ACD/IUPAC Name]
Imidazo[4,5-e]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione, 6-(1-acetyl-1,2-dihydro-2-oxo-3H-indol-3-ylidene)-3,3a,9,9a-tetrahydro-1,3-dimethyl-3a,9a-diphenyl- [ACD/Index 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: 716.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.7±3.0 kJ/mol
Flash Point: 386.9±35.7 °C
Index of Refraction: 1.763
Molar Refractivity: 156.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 97.87
ACD/KOC (pH 5.5): 925.79
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 97.87
ACD/KOC (pH 7.4): 925.79
Polar Surface Area: 131 Å2
Polarizability: 62.1±0.5 10-24cm3
Surface Tension: 66.8±7.0 dyne/cm
Molar Volume: 379.4±7.0 cm3

Click to predict properties on the Chemicalize site


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