ChemSpider 2D Image | N-{4-[3-(3,4-Dichlorobenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]phenyl}-2-phenylbutanamide | C27H27Cl2N3O2

N-{4-[3-(3,4-Dichlorobenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]phenyl}-2-phenylbutanamide

  • Molecular FormulaC27H27Cl2N3O2
  • Average mass496.428 Da
  • Monoisotopic mass495.148041 Da
  • ChemSpider ID22723642

More details:

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

Benzeneacetamide, N-[4-[3-[(3,4-dichlorophenyl)methyl]tetrahydro-2-oxo-1(2H)-pyrimidinyl]phenyl]-α-ethyl- [ACD/Index Name]
N-{4-[3-(3,4-Dichlorbenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]phenyl}-2-phenylbutanamid [German] [ACD/IUPAC Name]
N-{4-[3-(3,4-Dichlorobenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]phenyl}-2-phenylbutanamide [ACD/IUPAC Name]
N-{4-[3-(3,4-Dichlorobenzyl)-2-oxotétrahydro-1(2H)-pyrimidinyl]phényl}-2-phénylbutanamide [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: 686.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.7±3.0 kJ/mol
Flash Point: 369.1±31.5 °C
Index of Refraction: 1.643
Molar Refractivity: 137.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.04
ACD/LogD (pH 5.5): 5.73
ACD/BCF (pH 5.5): 13330.16
ACD/KOC (pH 5.5): 31198.62
ACD/LogD (pH 7.4): 5.73
ACD/BCF (pH 7.4): 13331.25
ACD/KOC (pH 7.4): 31201.15
Polar Surface Area: 53 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 57.6±3.0 dyne/cm
Molar Volume: 379.0±3.0 cm3

Click to predict properties on the Chemicalize site


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