Found 35 results

Search term: C39H38N4O8 (Found by molecular formula)
ChemSpider 2D Image | 4-Amino-1-[(1R,3R,4S,5R)-3-{[bis(4-methoxyphenyl)(phenyl)methoxy]methyl}-4-hydroxy-6-(phenoxyacetyl)-2-oxa-6-azabicyclo[3.2.0]hept-1-yl]-2(1H)-pyrimidinone | C39H38N4O8

4-Amino-1-[(1R,3R,4S,5R)-3-{[bis(4-methoxyphenyl)(phenyl)methoxy]methyl}-4-hydroxy-6-(phenoxyacetyl)-2-oxa-6-azabicyclo[3.2.0]hept-1-yl]-2(1H)-pyrimidinone

  • Molecular FormulaC39H38N4O8
  • Average mass690.741 Da
  • Monoisotopic mass690.268982 Da
  • ChemSpider ID9687950

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2(1H)-Pyrimidinone, 4-amino-1-[(1R,3R,4S,5R)-3-[[bis(4-methoxyphenyl)phenylmethoxy]methyl]-4-hydroxy-6-(2-phenoxyacetyl)-2-oxa-6-azabicyclo[3.2.0]hept-1-yl]- [ACD/Index Name]
4-Amino-1-[(1R,3R,4S,5R)-3-{[bis(4-méthoxyphényl)(phényl)méthoxy]méthyl}-4-hydroxy-6-(2-phénoxyacétyl)-2-oxa-6-azabicyclo[3.2.0]hept-1-yl]-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
4-Amino-1-[(1R,3R,4S,5R)-3-{[bis(4-methoxyphenyl)(phenyl)methoxy]methyl}-4-hydroxy-6-(phenoxyacetyl)-2-oxa-6-azabicyclo[3.2.0]hept-1-yl]-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-[(1R,3R,4S,5R)-3-{[bis(4-methoxyphenyl)(phenyl)methoxy]methyl}-4-hydroxy-6-(phenoxyacetyl)-2-oxa-6-azabicyclo[3.2.0]hept-1-yl]-2(1H)-pyrimidinone [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 874.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 133.2±3.0 kJ/mol
Flash Point: 482.7±37.1 °C
Index of Refraction: 1.648
Molar Refractivity: 187.5±0.5 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 6.74
ACD/LogD (pH 5.5): 4.86
ACD/BCF (pH 5.5): 2890.62
ACD/KOC (pH 5.5): 10286.61
ACD/LogD (pH 7.4): 4.89
ACD/BCF (pH 7.4): 3049.72
ACD/KOC (pH 7.4): 10852.78
Polar Surface Area: 145 Å2
Polarizability: 74.3±0.5 10-24cm3
Surface Tension: 54.3±7.0 dyne/cm
Molar Volume: 515.5±7.0 cm3

Click to predict properties on the Chemicalize site


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