ChemSpider 2D Image | [(2Z)-2-[(3,4-Dimethylphenyl)imino]-8-methyl-3-(1-naphthylcarbamoyl)-2H-pyrano[2,3-c]pyridin-5-yl]methyl acetate | C31H27N3O4

[(2Z)-2-[(3,4-Dimethylphenyl)imino]-8-methyl-3-(1-naphthylcarbamoyl)-2H-pyrano[2,3-c]pyridin-5-yl]methyl acetate

  • Molecular FormulaC31H27N3O4
  • Average mass505.564 Da
  • Monoisotopic mass505.200165 Da
  • ChemSpider ID3357837
  • Double-bond stereo - Double-bond stereo


More details:






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

[(2Z)-2-[(3,4-Dimethylphenyl)imino]-8-methyl-3-(1-naphthylcarbamoyl)-2H-pyrano[2,3-c]pyridin-5-yl]methyl acetate [ACD/IUPAC Name]
[(2Z)-2-[(3,4-Dimethylphenyl)imino]-8-methyl-3-(1-naphthylcarbamoyl)-2H-pyrano[2,3-c]pyridin-5-yl]methyl-acetat [German] [ACD/IUPAC Name]
2H-Pyrano[2,3-c]pyridine-3-carboxamide, 5-[(acetyloxy)methyl]-2-[(3,4-dimethylphenyl)imino]-8-methyl-N-1-naphthalenyl-, (2Z)- [ACD/Index Name]
Acétate de [(2Z)-2-[(3,4-diméthylphényl)imino]-8-méthyl-3-(1-naphtylcarbamoyl)-2H-pyrano[2,3-c]pyridin-5-yl]méthyle [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.635
Molar Refractivity: 145.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 6.82
ACD/LogD (pH 5.5): 5.93
ACD/BCF (pH 5.5): 18960.39
ACD/KOC (pH 5.5): 40141.17
ACD/LogD (pH 7.4): 5.93
ACD/BCF (pH 7.4): 18944.20
ACD/KOC (pH 7.4): 40106.89
Polar Surface Area: 90 Å2
Polarizability: 57.7±0.5 10-24cm3
Surface Tension: 45.6±7.0 dyne/cm
Molar Volume: 406.5±7.0 cm3

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