ChemSpider 2D Image | 2-Chloro-N-{1-(3,4-dimethoxyphenyl)-2-[(4-methylcyclohexyl)amino]-2-oxoethyl}-N-(3-methoxybenzyl)acetamide | C27H35ClN2O5

2-Chloro-N-{1-(3,4-dimethoxyphenyl)-2-[(4-methylcyclohexyl)amino]-2-oxoethyl}-N-(3-methoxybenzyl)acetamide

  • Molecular FormulaC27H35ClN2O5
  • Average mass503.030 Da
  • Monoisotopic mass502.223450 Da
  • ChemSpider ID34273910

More details:

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

2-Chlor-N-{1-(3,4-dimethoxyphenyl)-2-[(4-methylcyclohexyl)amino]-2-oxoethyl}-N-(3-methoxybenzyl)acetamid [German] [ACD/IUPAC Name]
2-Chloro-N-{1-(3,4-dimethoxyphenyl)-2-[(4-methylcyclohexyl)amino]-2-oxoethyl}-N-(3-methoxybenzyl)acetamide [ACD/IUPAC Name]
2-Chloro-N-{1-(3,4-diméthoxyphényl)-2-[(4-méthylcyclohexyl)amino]-2-oxoéthyl}-N-(3-méthoxybenzyl)acétamide [French] [ACD/IUPAC Name]
Benzeneacetamide, α-[(2-chloroacetyl)[(3-methoxyphenyl)methyl]amino]-3,4-dimethoxy-N-(4-methylcyclohexyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 695.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.9±3.0 kJ/mol
Flash Point: 374.6±31.5 °C
Index of Refraction: 1.576
Molar Refractivity: 136.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.48
ACD/LogD (pH 5.5): 4.11
ACD/BCF (pH 5.5): 781.89
ACD/KOC (pH 5.5): 4097.45
ACD/LogD (pH 7.4): 4.11
ACD/BCF (pH 7.4): 781.89
ACD/KOC (pH 7.4): 4097.45
Polar Surface Area: 77 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 50.8±5.0 dyne/cm
Molar Volume: 413.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement