ChemSpider 2D Image | N-[2-(Cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-[3-(trifluoromethyl)phenyl]-2-pyrazinecarboxamide | C27H27F3N4O3

N-[2-(Cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-[3-(trifluoromethyl)phenyl]-2-pyrazinecarboxamide

  • Molecular FormulaC27H27F3N4O3
  • Average mass512.523 Da
  • Monoisotopic mass512.203552 Da
  • ChemSpider ID2435908

More details:

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

2-Pyrazinecarboxamide, N-[2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
N-[2-(Cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-[3-(trifluormethyl)phenyl]-2-pyrazincarboxamid [German] [ACD/IUPAC Name]
N-[2-(Cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-[3-(trifluoromethyl)phenyl]-2-pyrazinecarboxamide [ACD/IUPAC Name]
N-[2-(Cyclohexylamino)-1-(4-méthoxyphényl)-2-oxoéthyl]-N-[3-(trifluorométhyl)phényl]-2-pyrazinecarboxamide [French] [ACD/IUPAC Name]
N-CYCLOHEXYL-2-(4-METHOXYPHENYL)-2-[1-(PYRAZIN-2-YL)-N-[3-(TRIFLUOROMETHYL)PHENYL]FORMAMIDO]ACETAMIDE
N-CYCLOHEXYL-2-(4-METHOXYPHENYL)-2-{1-PYRAZIN-2-YL-N-[3-(TRIFLUOROMETHYL)PHENYL]FORMAMIDO}ACETAMIDE

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

ASN 04361681 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 700.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 377.7±32.9 °C
Index of Refraction: 1.594
Molar Refractivity: 130.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 4.25
ACD/BCF (pH 5.5): 1003.32
ACD/KOC (pH 5.5): 4898.13
ACD/LogD (pH 7.4): 4.25
ACD/BCF (pH 7.4): 1003.32
ACD/KOC (pH 7.4): 4898.12
Polar Surface Area: 84 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 56.7±5.0 dyne/cm
Molar Volume: 384.4±5.0 cm3

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