ChemSpider 2D Image | N-[2-(Cyclopentylamino)-1-(4-fluorophenyl)-2-oxoethyl]-N-(2,3-dimethylphenyl)-6-(isopropylamino)nicotinamide | C30H35FN4O2

N-[2-(Cyclopentylamino)-1-(4-fluorophenyl)-2-oxoethyl]-N-(2,3-dimethylphenyl)-6-(isopropylamino)nicotinamide

  • Molecular FormulaC30H35FN4O2
  • Average mass502.623 Da
  • Monoisotopic mass502.274414 Da
  • ChemSpider ID2470216

More details:

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

3-Pyridinecarboxamide, N-[2-(cyclopentylamino)-1-(4-fluorophenyl)-2-oxoethyl]-N-(2,3-dimethylphenyl)-6-[(1-methylethyl)amino]- [ACD/Index Name]
N-[2-(Cyclopentylamino)-1-(4-fluorophenyl)-2-oxoethyl]-N-(2,3-dimethylphenyl)-6-(isopropylamino)nicotinamide [ACD/IUPAC Name]
N-[2-(Cyclopentylamino)-1-(4-fluorophényl)-2-oxoéthyl]-N-(2,3-diméthylphényl)-6-(isopropylamino)nicotinamide [French] [ACD/IUPAC Name]
N-[2-(Cyclopentylamino)-1-(4-fluorphenyl)-2-oxoethyl]-N-(2,3-dimethylphenyl)-6-(isopropylamino)nicotinamid [German] [ACD/IUPAC Name]

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

ASN 06264555 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 730.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.6±3.0 kJ/mol
Flash Point: 395.6±32.9 °C
Index of Refraction: 1.609
Molar Refractivity: 143.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.07
ACD/LogD (pH 5.5): 5.36
ACD/BCF (pH 5.5): 6900.09
ACD/KOC (pH 5.5): 19264.60
ACD/LogD (pH 7.4): 5.38
ACD/BCF (pH 7.4): 7163.44
ACD/KOC (pH 7.4): 19999.85
Polar Surface Area: 74 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 54.6±5.0 dyne/cm
Molar Volume: 414.8±5.0 cm3

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