ChemSpider 2D Image | N~2~-Cyclohexyl-3-(4-cyclohexylphenyl)-7-methyl-N~6~-(5-methyl-1,2-oxazol-3-yl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.0~1,5~]dec-8-ene-2,6-dicarboxamide | C33H40N4O5

N2-Cyclohexyl-3-(4-cyclohexylphenyl)-7-methyl-N6-(5-methyl-1,2-oxazol-3-yl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide

  • Molecular FormulaC33H40N4O5
  • Average mass572.695 Da
  • Monoisotopic mass572.299866 Da
  • ChemSpider ID2471248

More details:

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

3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-2-(4-cyclohexylphenyl)-1,2,3,6,7,7a-hexahydro-6-methyl-N7-(5-methyl-3-isoxazolyl)-1-oxo- [ACD/Index Name]
N2-Cyclohexyl-3-(4-cyclohexylphenyl)-7-methyl-N6-(5-methyl-1,2-oxazol-3-yl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-en-2,6-dicarboxamid [German] [ACD/IUPAC Name]
N2-Cyclohexyl-3-(4-cyclohexylphenyl)-7-methyl-N6-(5-methyl-1,2-oxazol-3-yl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide [ACD/IUPAC Name]
N2-Cyclohexyl-3-(4-cyclohexylphényl)-7-méthyl-N6-(5-méthyl-1,2-oxazol-3-yl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]déc-8-ène-2,6-dicarboxamide [French] [ACD/IUPAC Name]

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

ASN 06387802 [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: 891.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 129.6±3.0 kJ/mol
Flash Point: 492.7±34.3 °C
Index of Refraction: 1.636
Molar Refractivity: 155.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.61
ACD/LogD (pH 5.5): 4.39
ACD/BCF (pH 5.5): 1280.53
ACD/KOC (pH 5.5): 5832.69
ACD/LogD (pH 7.4): 4.39
ACD/BCF (pH 7.4): 1280.51
ACD/KOC (pH 7.4): 5832.56
Polar Surface Area: 114 Å2
Polarizability: 61.7±0.5 10-24cm3
Surface Tension: 63.6±5.0 dyne/cm
Molar Volume: 434.7±5.0 cm3

Click to predict properties on the Chemicalize site


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