ChemSpider 2D Image | N-{[5-Amino-4-(methoxymethyl)-6-methyl-3-pyridinyl]methyl}-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-trimethoxyphenyl)propanamide | C27H33N3O8

N-{[5-Amino-4-(methoxymethyl)-6-methyl-3-pyridinyl]methyl}-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-trimethoxyphenyl)propanamide

  • Molecular FormulaC27H33N3O8
  • Average mass527.566 Da
  • Monoisotopic mass527.226746 Da
  • ChemSpider ID44205904

More details:

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

2H-Pyran-3-propanamide, N-[[5-amino-4-(methoxymethyl)-6-methyl-3-pyridinyl]methyl]-4-hydroxy-6-methyl-2-oxo-β-(2,3,4-trimethoxyphenyl)- [ACD/Index Name]
N-{[5-Amino-4-(methoxymethyl)-6-methyl-3-pyridinyl]methyl}-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-trimethoxyphenyl)propanamid [German] [ACD/IUPAC Name]
N-{[5-Amino-4-(methoxymethyl)-6-methyl-3-pyridinyl]methyl}-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-trimethoxyphenyl)propanamide [ACD/IUPAC Name]
N-{[5-Amino-4-(méthoxyméthyl)-6-méthyl-3-pyridinyl]méthyl}-3-(4-hydroxy-6-méthyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-triméthoxyphényl)propanamide [French] [ACD/IUPAC Name]
N-((5-amino-4-(methoxymethyl)-6-methylpyridin-3-yl)methyl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-trimethoxyphenyl)propanamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 784.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.7±3.0 kJ/mol
Flash Point: 428.2±32.9 °C
Index of Refraction: 1.599
Molar Refractivity: 140.0±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 0.70
ACD/LogD (pH 5.5): 0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.48
ACD/LogD (pH 7.4): -1.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 151 Å2
Polarizability: 55.5±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 409.7±3.0 cm3

Click to predict properties on the Chemicalize site


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