ChemSpider 2D Image | 3-(Carbamoylamino)-3-(4-chlorophenyl)-N-[(4-chlorophenyl)(1-methyl-1H-imidazol-2-yl)methyl]propanamide | C21H21Cl2N5O2

3-(Carbamoylamino)-3-(4-chlorophenyl)-N-[(4-chlorophenyl)(1-methyl-1H-imidazol-2-yl)methyl]propanamide

  • Molecular FormulaC21H21Cl2N5O2
  • Average mass446.330 Da
  • Monoisotopic mass445.107239 Da
  • ChemSpider ID22458773

More details:

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

3-(Carbamoylamino)-3-(4-chlorophenyl)-N-[(4-chlorophenyl)(1-methyl-1H-imidazol-2-yl)methyl]propanamide [ACD/IUPAC Name]
3-(Carbamoylamino)-3-(4-chlorophényl)-N-[(4-chlorophényl)(1-méthyl-1H-imidazol-2-yl)méthyl]propanamide [French] [ACD/IUPAC Name]
3-(Carbamoylamino)-3-(4-chlorphenyl)-N-[(4-chlorphenyl)(1-methyl-1H-imidazol-2-yl)methyl]propanamid [German] [ACD/IUPAC Name]
Benzenepropanamide, β-[(aminocarbonyl)amino]-4-chloro-N-[(4-chlorophenyl)(1-methyl-1H-imidazol-2-yl)methyl]- [ACD/Index Name]
3-(CARBAMOYLAMINO)-3-(4-CHLOROPHENYL)-N-[(4-CHLOROPHENYL)(1-METHYLIMIDAZOL-2-YL)METHYL]PROPANAMIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 735.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.3±3.0 kJ/mol
Flash Point: 398.8±32.9 °C
Index of Refraction: 1.658
Molar Refractivity: 117.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.76
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 32.85
ACD/KOC (pH 5.5): 303.77
ACD/LogD (pH 7.4): 2.95
ACD/BCF (pH 7.4): 103.07
ACD/KOC (pH 7.4): 953.17
Polar Surface Area: 102 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 53.6±7.0 dyne/cm
Molar Volume: 318.9±7.0 cm3

Click to predict properties on the Chemicalize site


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