ChemSpider 2D Image | N-(3,4-Dichlorobenzyl)-3-[4,6-dimethyl-2-(methylsulfanyl)-5-pyrimidinyl]-N-isopropylpropanamide | C20H25Cl2N3OS

N-(3,4-Dichlorobenzyl)-3-[4,6-dimethyl-2-(methylsulfanyl)-5-pyrimidinyl]-N-isopropylpropanamide

  • Molecular FormulaC20H25Cl2N3OS
  • Average mass426.403 Da
  • Monoisotopic mass425.109528 Da
  • ChemSpider ID31632771

More details:

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

5-Pyrimidinepropanamide, N-[(3,4-dichlorophenyl)methyl]-4,6-dimethyl-N-(1-methylethyl)-2-(methylthio)- [ACD/Index Name]
N-(3,4-Dichlorbenzyl)-3-[4,6-dimethyl-2-(methylsulfanyl)-5-pyrimidinyl]-N-isopropylpropanamid [German] [ACD/IUPAC Name]
N-(3,4-Dichlorobenzyl)-3-[4,6-dimethyl-2-(methylsulfanyl)-5-pyrimidinyl]-N-isopropylpropanamide [ACD/IUPAC Name]
N-(3,4-Dichlorobenzyl)-3-[4,6-diméthyl-2-(méthylsulfanyl)-5-pyrimidinyl]-N-isopropylpropanamide [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: 582.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 306.0±30.1 °C
Index of Refraction: 1.597
Molar Refractivity: 115.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 5.67
ACD/BCF (pH 5.5): 12037.37
ACD/KOC (pH 5.5): 28994.05
ACD/LogD (pH 7.4): 5.67
ACD/BCF (pH 7.4): 12049.32
ACD/KOC (pH 7.4): 29022.84
Polar Surface Area: 71 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 55.2±5.0 dyne/cm
Molar Volume: 337.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement