ChemSpider 2D Image | 2-(2-Furylmethyl)-N-[1-({2-[(4-methoxyphenyl)sulfonyl]-2-(3-pyridinyl)ethyl}amino)-1-oxo-2-pentanyl]-1,3-dioxo-5-isoindolinecarboxamide | C33H32N4O8S

2-(2-Furylmethyl)-N-[1-({2-[(4-methoxyphenyl)sulfonyl]-2-(3-pyridinyl)ethyl}amino)-1-oxo-2-pentanyl]-1,3-dioxo-5-isoindolinecarboxamide

  • Molecular FormulaC33H32N4O8S
  • Average mass644.694 Da
  • Monoisotopic mass644.194092 Da
  • ChemSpider ID121194241

More details:

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

1H-Isoindole-5-carboxamide, 2-(2-furanylmethyl)-2,3-dihydro-N-[1-[[[2-[(4-methoxyphenyl)sulfonyl]-2-(3-pyridinyl)ethyl]amino]carbonyl]butyl]-1,3-dioxo- [ACD/Index Name]
2-(2-Furylmethyl)-N-[1-({2-[(4-methoxyphenyl)sulfonyl]-2-(3-pyridinyl)ethyl}amino)-1-oxo-2-pentanyl]-1,3-dioxo-5-isoindolincarboxamid [German] [ACD/IUPAC Name]
2-(2-Furylmethyl)-N-[1-({2-[(4-methoxyphenyl)sulfonyl]-2-(3-pyridinyl)ethyl}amino)-1-oxo-2-pentanyl]-1,3-dioxo-5-isoindolinecarboxamide [ACD/IUPAC Name]
2-(2-Furylméthyl)-N-[1-({2-[(4-méthoxyphényl)sulfonyl]-2-(3-pyridinyl)éthyl}amino)-1-oxo-2-pentanyl]-1,3-dioxo-5-isoindolinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 928.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 135.2±3.0 kJ/mol
Flash Point: 515.6±34.3 °C
Index of Refraction: 1.621
Molar Refractivity: 166.8±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 2.55
ACD/BCF (pH 5.5): 50.58
ACD/KOC (pH 5.5): 576.32
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 50.86
ACD/KOC (pH 7.4): 579.48
Polar Surface Area: 173 Å2
Polarizability: 66.1±0.5 10-24cm3
Surface Tension: 60.3±3.0 dyne/cm
Molar Volume: 474.2±3.0 cm3

Click to predict properties on the Chemicalize site


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