ChemSpider 2D Image | N-(2-{4-[(4-Chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(tetrahydro-2-furanylmethyl)cyclopentanecarboxamide | C27H33ClN2O4S

N-(2-{4-[(4-Chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(tetrahydro-2-furanylmethyl)cyclopentanecarboxamide

  • Molecular FormulaC27H33ClN2O4S
  • Average mass517.080 Da
  • Monoisotopic mass516.184937 Da
  • ChemSpider ID22669126

More details:

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

Cyclopentanecarboxamide, N-[2-[4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-2-oxoethyl]-N-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]
N-(2-{4-[(4-Chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(tetrahydro-2-furanylmethyl)cyclopentanecarboxamide [ACD/IUPAC Name]
N-(2-{4-[(4-Chlorophénoxy)méthyl]-6,7-dihydrothiéno[3,2-c]pyridin-5(4H)-yl}-2-oxoéthyl)-N-(tétrahydro-2-furanylméthyl)cyclopentanecarboxamide [French] [ACD/IUPAC Name]
N-(2-{4-[(4-Chlorphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(tetrahydro-2-furanylmethyl)cyclopentancarboxamid [German] [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: 711.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.0±3.0 kJ/mol
Flash Point: 383.9±32.9 °C
Index of Refraction: 1.596
Molar Refractivity: 137.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 4.50
ACD/BCF (pH 5.5): 1558.32
ACD/KOC (pH 5.5): 6712.78
ACD/LogD (pH 7.4): 4.50
ACD/BCF (pH 7.4): 1558.32
ACD/KOC (pH 7.4): 6712.78
Polar Surface Area: 87 Å2
Polarizability: 54.5±0.5 10-24cm3
Surface Tension: 52.6±3.0 dyne/cm
Molar Volume: 403.9±3.0 cm3

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