ChemSpider 2D Image | N-[2-(Cyclohexylamino)-1-(4-methylphenyl)-2-oxoethyl]-N-(2,4-dimethoxyphenyl)-N'-(2-pyridinyl)pentanediamide | C33H40N4O5

N-[2-(Cyclohexylamino)-1-(4-methylphenyl)-2-oxoethyl]-N-(2,4-dimethoxyphenyl)-N'-(2-pyridinyl)pentanediamide

  • Molecular FormulaC33H40N4O5
  • Average mass572.695 Da
  • Monoisotopic mass572.299866 Da
  • ChemSpider ID2448408

More details:

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

N-[2-(Cyclohexylamino)-1-(4-methylphenyl)-2-oxoethyl]-N-(2,4-dimethoxyphenyl)-N'-(2-pyridinyl)pentandiamid [German] [ACD/IUPAC Name]
N-[2-(Cyclohexylamino)-1-(4-methylphenyl)-2-oxoethyl]-N-(2,4-dimethoxyphenyl)-N'-(2-pyridinyl)pentanediamide [ACD/IUPAC Name]
N-[2-(Cyclohexylamino)-1-(4-méthylphényl)-2-oxoéthyl]-N-(2,4-diméthoxyphényl)-N'-(2-pyridinyl)pentanediamide [French] [ACD/IUPAC Name]
Pentanediamide, N1-[2-(cyclohexylamino)-1-(4-methylphenyl)-2-oxoethyl]-N1-(2,4-dimethoxyphenyl)-N5-2-pyridinyl- [ACD/Index Name]

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

ASN 05258125 [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: 846.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 123.0±3.0 kJ/mol
Flash Point: 465.7±34.3 °C
Index of Refraction: 1.606
Molar Refractivity: 161.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 4.37
ACD/LogD (pH 5.5): 4.29
ACD/BCF (pH 5.5): 1072.18
ACD/KOC (pH 5.5): 5120.52
ACD/LogD (pH 7.4): 4.30
ACD/BCF (pH 7.4): 1083.83
ACD/KOC (pH 7.4): 5176.15
Polar Surface Area: 110 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 58.1±5.0 dyne/cm
Molar Volume: 466.5±5.0 cm3

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