ChemSpider 2D Image | N-Cyclohexyl-2-ethyl-7-(4-methoxybenzyl)-8-oxo-6-phenyl-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide | C32H35N3O3S

N-Cyclohexyl-2-ethyl-7-(4-methoxybenzyl)-8-oxo-6-phenyl-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide

  • Molecular FormulaC32H35N3O3S
  • Average mass541.704 Da
  • Monoisotopic mass541.239929 Da
  • ChemSpider ID20342476

More details:

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

N-Cyclohexyl-2-ethyl-7-(4-methoxybenzyl)-8-oxo-6-phenyl-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazin-6-carboxamid [German] [ACD/IUPAC Name]
N-Cyclohexyl-2-ethyl-7-(4-methoxybenzyl)-8-oxo-6-phenyl-5,6,7,8-tetrahydrothieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide [ACD/IUPAC Name]
N-Cyclohexyl-2-éthyl-7-(4-méthoxybenzyl)-8-oxo-6-phényl-5,6,7,8-tétrahydrothiéno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide [French] [ACD/IUPAC Name]
Thieno[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide, N-cyclohexyl-2-ethyl-5,6,7,8-tetrahydro-7-[(4-methoxyphenyl)methyl]-8-oxo-6-phenyl- [ACD/Index 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: 791.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.0±3.0 kJ/mol
Flash Point: 432.2±32.9 °C
Index of Refraction: 1.667
Molar Refractivity: 156.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.06
ACD/LogD (pH 5.5): 5.78
ACD/BCF (pH 5.5): 14637.40
ACD/KOC (pH 5.5): 33360.05
ACD/LogD (pH 7.4): 5.78
ACD/BCF (pH 7.4): 14637.40
ACD/KOC (pH 7.4): 33360.05
Polar Surface Area: 92 Å2
Polarizability: 62.1±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 421.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement