ChemSpider 2D Image | 2-{3-[3-(Cyclohexylsulfonyl)propyl]-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl}-N-ethyl-N-(3-methylphenyl)acetamide | C28H35N3O5S

2-{3-[3-(Cyclohexylsulfonyl)propyl]-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl}-N-ethyl-N-(3-methylphenyl)acetamide

  • Molecular FormulaC28H35N3O5S
  • Average mass525.660 Da
  • Monoisotopic mass525.229736 Da
  • ChemSpider ID13120736

More details:

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

1(2H)-Quinazolineacetamide, 3-[3-(cyclohexylsulfonyl)propyl]-N-ethyl-3,4-dihydro-N-(3-methylphenyl)-2,4-dioxo- [ACD/Index Name]
2-{3-[3-(Cyclohexylsulfonyl)propyl]-2,4-dioxo-3,4-dihydro-1(2H)-chinazolinyl}-N-ethyl-N-(3-methylphenyl)acetamid [German] [ACD/IUPAC Name]
2-{3-[3-(Cyclohexylsulfonyl)propyl]-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl}-N-ethyl-N-(3-methylphenyl)acetamide [ACD/IUPAC Name]
2-{3-[3-(Cyclohexylsulfonyl)propyl]-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl}-N-éthyl-N-(3-méthylphényl)acétamide [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: 740.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.0±3.0 kJ/mol
Flash Point: 401.4±35.7 °C
Index of Refraction: 1.627
Molar Refractivity: 142.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.71
ACD/LogD (pH 5.5): 4.04
ACD/BCF (pH 5.5): 687.84
ACD/KOC (pH 5.5): 3738.28
ACD/LogD (pH 7.4): 4.04
ACD/BCF (pH 7.4): 687.85
ACD/KOC (pH 7.4): 3738.33
Polar Surface Area: 103 Å2
Polarizability: 56.4±0.5 10-24cm3
Surface Tension: 62.6±5.0 dyne/cm
Molar Volume: 401.1±5.0 cm3

Click to predict properties on the Chemicalize site


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