ChemSpider 2D Image | 3,5-Bis(benzylsulfanyl)-1,7-dipropyl-5,7-dihydropyrrolo[3,2-f]indole-2,6(1H,3H)-dione | C30H32N2O2S2

3,5-Bis(benzylsulfanyl)-1,7-dipropyl-5,7-dihydropyrrolo[3,2-f]indole-2,6(1H,3H)-dione

  • Molecular FormulaC30H32N2O2S2
  • Average mass516.717 Da
  • Monoisotopic mass516.190491 Da
  • ChemSpider ID28409866

More details:

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

3,5-Bis(benzylsulfanyl)-1,7-dipropyl-5,7-dihydropyrrolo[3,2-f]indol-2,6(1H,3H)-dion [German] [ACD/IUPAC Name]
3,5-Bis(benzylsulfanyl)-1,7-dipropyl-5,7-dihydropyrrolo[3,2-f]indole-2,6(1H,3H)-dione [ACD/IUPAC Name]
3,5-Bis(benzylsulfanyl)-1,7-dipropyl-5,7-dihydropyrrolo[3,2-f]indole-2,6(1H,3H)-dione [French] [ACD/IUPAC Name]
Pyrrolo[3,2-f]indole-2,6(1H,3H)-dione, 5,7-dihydro-3,5-bis[(phenylmethyl)thio]-1,7-dipropyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 773.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.5±3.0 kJ/mol
Flash Point: 421.3±32.9 °C
Index of Refraction: 1.681
Molar Refractivity: 151.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.70
ACD/LogD (pH 5.5): 5.56
ACD/BCF (pH 5.5): 9832.58
ACD/KOC (pH 5.5): 25092.32
ACD/LogD (pH 7.4): 5.56
ACD/BCF (pH 7.4): 9832.59
ACD/KOC (pH 7.4): 25092.35
Polar Surface Area: 91 Å2
Polarizability: 60.1±0.5 10-24cm3
Surface Tension: 63.5±5.0 dyne/cm
Molar Volume: 400.8±5.0 cm3

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