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

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

  • Molecular FormulaC33H32N4O8S
  • Average mass644.694 Da
  • Monoisotopic mass644.194092 Da
  • ChemSpider ID121208541

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]-1-methylpropyl]-1,3-dioxo- [ACD/Index Name]
2-(2-Furylmethyl)-N-[1-({2-[(4-methoxyphenyl)sulfonyl]-2-(3-pyridinyl)ethyl}amino)-2-methyl-1-oxo-2-butanyl]-1,3-dioxo-5-isoindolincarboxamid [German] [ACD/IUPAC Name]
2-(2-Furylmethyl)-N-[1-({2-[(4-methoxyphenyl)sulfonyl]-2-(3-pyridinyl)ethyl}amino)-2-methyl-1-oxo-2-butanyl]-1,3-dioxo-5-isoindolinecarboxamide [ACD/IUPAC Name]
2-(2-Furylméthyl)-N-[1-({2-[(4-méthoxyphényl)sulfonyl]-2-(3-pyridinyl)éthyl}amino)-2-méthyl-1-oxo-2-butanyl]-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: 923.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 134.4±3.0 kJ/mol
Flash Point: 512.5±34.3 °C
Index of Refraction: 1.622
Molar Refractivity: 166.9±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 2.66
ACD/BCF (pH 5.5): 61.41
ACD/KOC (pH 5.5): 662.07
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 7.4): 61.76
ACD/KOC (pH 7.4): 665.88
Polar Surface Area: 173 Å2
Polarizability: 66.2±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 473.9±3.0 cm3

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