ChemSpider 2D Image | N-(2,6-Diethylphenyl)-2-[(4-oxo-1,4,5,6,7,8-hexahydro-2-quinazolinyl)sulfanyl]propanamide | C21H27N3O2S

N-(2,6-Diethylphenyl)-2-[(4-oxo-1,4,5,6,7,8-hexahydro-2-quinazolinyl)sulfanyl]propanamide

  • Molecular FormulaC21H27N3O2S
  • Average mass385.523 Da
  • Monoisotopic mass385.182404 Da
  • ChemSpider ID18486574

More details:

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

N-(2,6-Diethylphenyl)-2-[(4-oxo-1,4,5,6,7,8-hexahydro-2-chinazolinyl)sulfanyl]propanamid [German] [ACD/IUPAC Name]
N-(2,6-Diethylphenyl)-2-[(4-oxo-1,4,5,6,7,8-hexahydro-2-quinazolinyl)sulfanyl]propanamide [ACD/IUPAC Name]
N-(2,6-Diéthylphényl)-2-[(4-oxo-1,4,5,6,7,8-hexahydro-2-quinazolinyl)sulfanyl]propanamide [French] [ACD/IUPAC Name]
N-(2,6-Diethylphenyl)-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]propanamide
Propanamide, N-(2,6-diethylphenyl)-2-[(3,4,5,6,7,8-hexahydro-4-oxo-2-quinazolinyl)thio]- [ACD/Index Name]
N-(2,6-diethylphenyl)-2-(4-oxo(3,5,6,7,8-pentahydroquinazolin-2-ylthio))propanamide
N-(2,6-diethylphenyl)-2-[(4-oxo-3,4,5,6,7,8-hexahydro-2-quinazolinyl)thio]propanamide
N-(2,6-diethylphenyl)-2-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)sulfanyl]propanamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.638
Molar Refractivity: 109.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.22
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 525.97
ACD/KOC (pH 5.5): 3084.87
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 520.17
ACD/KOC (pH 7.4): 3050.82
Polar Surface Area: 96 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 46.6±7.0 dyne/cm
Molar Volume: 305.6±7.0 cm3

Click to predict properties on the Chemicalize site


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