ChemSpider 2D Image | N,N-Diethyl-4-(4-{[4-(phenylcarbamoyl)phenyl]amino}-1-phthalazinyl)benzamide | C32H29N5O2

N,N-Diethyl-4-(4-{[4-(phenylcarbamoyl)phenyl]amino}-1-phthalazinyl)benzamide

  • Molecular FormulaC32H29N5O2
  • Average mass515.605 Da
  • Monoisotopic mass515.232117 Da
  • ChemSpider ID4921771

More details:

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

Benzamide, N,N-diethyl-4-[4-[[4-[(phenylamino)carbonyl]phenyl]amino]-1-phthalazinyl]- [ACD/Index Name]
N,N-Diéthyl-4-(4-{[4-(phénylcarbamoyl)phényl]amino}-1-phtalazinyl)benzamide [French] [ACD/IUPAC Name]
N,N-Diethyl-4-(4-{[4-(phenylcarbamoyl)phenyl]amino}-1-phthalazinyl)benzamid [German] [ACD/IUPAC Name]
N,N-Diethyl-4-(4-{[4-(phenylcarbamoyl)phenyl]amino}-1-phthalazinyl)benzamide [ACD/IUPAC Name]
N,N-DIETHYL-4-[4-[4-(PHENYLCARBAMOYL)ANILINO]PHTHALAZIN-1-YL]BENZAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 700.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.5±3.0 kJ/mol
Flash Point: 377.2±32.9 °C
Index of Refraction: 1.692
Molar Refractivity: 156.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.53
ACD/LogD (pH 5.5): 4.82
ACD/BCF (pH 5.5): 2642.90
ACD/KOC (pH 5.5): 9606.17
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2830.38
ACD/KOC (pH 7.4): 10287.59
Polar Surface Area: 87 Å2
Polarizability: 62.0±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 408.5±3.0 cm3

Click to predict properties on the Chemicalize site


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