ChemSpider 2D Image | 3-[(E)-2,3-Dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino]-N-[3-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)propyl]-N-methyl-1-propanamine | C29H35N7

3-[(E)-2,3-Dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino]-N-[3-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)propyl]-N-methyl-1-propanamine

  • Molecular FormulaC29H35N7
  • Average mass481.635 Da
  • Monoisotopic mass481.295380 Da
  • ChemSpider ID29360956

  • Double-bond stereo - Double-bond stereo

More details:

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

1,3-Propanediamine, N3-[(9E)-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylidene]-N1-[3-[(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylidene)amino]propyl]-N1-methyl- [ACD/Index Name]
3-[(E)-2,3-Dihydropyrrolo[2,1-b]chinazolin-9(1H)-ylidenamino]-N-[3-(2,3-dihydropyrrolo[2,1-b]chinazolin-9(1H)-ylidenamino)propyl]-N-methyl-1-propanamin [German] [ACD/IUPAC Name]
3-[(E)-2,3-Dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino]-N-[3-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)propyl]-N-methyl-1-propanamine [ACD/IUPAC Name]
3-[(E)-2,3-Dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylidèneamino]-N-[3-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylidèneamino)propyl]-N-méthyl-1-propanamine [French] [ACD/IUPAC 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: 663.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.5±3.0 kJ/mol
Flash Point: 354.8±34.3 °C
Index of Refraction: 1.692
Molar Refractivity: 144.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.56
ACD/LogD (pH 5.5): -0.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 2.53
ACD/KOC (pH 7.4): 15.00
Polar Surface Area: 59 Å2
Polarizability: 57.4±0.5 10-24cm3
Surface Tension: 52.8±7.0 dyne/cm
Molar Volume: 378.1±7.0 cm3

Click to predict properties on the Chemicalize site


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