ChemSpider 2D Image | N-[4-(4-Cyanophenoxy)cyclohexyl]-3-[(4-oxo-3,4-dihydro-2-quinazolinyl)sulfanyl]propanamide | C24H24N4O3S

N-[4-(4-Cyanophenoxy)cyclohexyl]-3-[(4-oxo-3,4-dihydro-2-quinazolinyl)sulfanyl]propanamide

  • Molecular FormulaC24H24N4O3S
  • Average mass448.537 Da
  • Monoisotopic mass448.156921 Da
  • ChemSpider ID82963391

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

N-[4-(4-Cyanophenoxy)cyclohexyl]-3-[(4-oxo-3,4-dihydro-2-quinazolinyl)sulfanyl]propanamide [ACD/IUPAC Name]
N-[4-(4-Cyanophénoxy)cyclohexyl]-3-[(4-oxo-3,4-dihydro-2-quinazolinyl)sulfanyl]propanamide [French] [ACD/IUPAC Name]
N-[4-(4-Cyanphenoxy)cyclohexyl]-3-[(4-oxo-3,4-dihydro-2-chinazolinyl)sulfanyl]propanamid [German] [ACD/IUPAC Name]
Propanamide, N-[4-(4-cyanophenoxy)cyclohexyl]-3-[(3,4-dihydro-4-oxo-2-quinazolinyl)thio]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.679
Molar Refractivity: 124.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 3.31
ACD/BCF (pH 5.5): 192.15
ACD/KOC (pH 5.5): 1500.45
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 190.63
ACD/KOC (pH 7.4): 1488.58
Polar Surface Area: 129 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 56.7±7.0 dyne/cm
Molar Volume: 331.0±7.0 cm3

Click to predict properties on the Chemicalize site


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