ChemSpider 2D Image | [4-(2-Methyl-2-propanyl)phenyl]{4-[3-(2-naphthyl)-6-propyl[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-1-piperazinyl}methanone | C33H35N5O2

[4-(2-Methyl-2-propanyl)phenyl]{4-[3-(2-naphthyl)-6-propyl[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-1-piperazinyl}methanone

  • Molecular FormulaC33H35N5O2
  • Average mass533.663 Da
  • Monoisotopic mass533.279053 Da
  • ChemSpider ID29255412

More details:

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

[4-(2-Methyl-2-propanyl)phenyl]{4-[3-(2-naphthyl)-6-propyl[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-1-piperazinyl}methanon [German] [ACD/IUPAC Name]
[4-(2-Methyl-2-propanyl)phenyl]{4-[3-(2-naphthyl)-6-propyl[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-1-piperazinyl}methanone [ACD/IUPAC Name]
[4-(2-Méthyl-2-propanyl)phényl]{4-[3-(2-naphtyl)-6-propyl[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-1-pipérazinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, [4-(1,1-dimethylethyl)phenyl][4-[3-(2-naphthalenyl)-6-propylisoxazolo[5,4-d]pyrimidin-4-yl]-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 684.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.3±3.0 kJ/mol
Flash Point: 367.6±31.5 °C
Index of Refraction: 1.640
Molar Refractivity: 159.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 5.60
ACD/BCF (pH 5.5): 10572.10
ACD/KOC (pH 5.5): 26339.30
ACD/LogD (pH 7.4): 5.60
ACD/BCF (pH 7.4): 10697.98
ACD/KOC (pH 7.4): 26652.90
Polar Surface Area: 75 Å2
Polarizability: 63.1±0.5 10-24cm3
Surface Tension: 55.0±3.0 dyne/cm
Molar Volume: 441.8±3.0 cm3

Click to predict properties on the Chemicalize site


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