ChemSpider 2D Image | 2-(2-Chlorophenyl)-1,3-dioxo-N-{1-oxo-1-[4-(1,3,5-triazin-2-yl)-1-piperidinyl]-2-butanyl}-5-isoindolinecarboxamide | C27H25ClN6O4

2-(2-Chlorophenyl)-1,3-dioxo-N-{1-oxo-1-[4-(1,3,5-triazin-2-yl)-1-piperidinyl]-2-butanyl}-5-isoindolinecarboxamide

  • Molecular FormulaC27H25ClN6O4
  • Average mass532.978 Da
  • Monoisotopic mass532.162598 Da
  • ChemSpider ID122212561

More details:

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

1H-Isoindole-5-carboxamide, 2-(2-chlorophenyl)-2,3-dihydro-1,3-dioxo-N-[1-[[4-(1,3,5-triazin-2-yl)-1-piperidinyl]carbonyl]propyl]- [ACD/Index Name]
2-(2-Chlorophenyl)-1,3-dioxo-N-{1-oxo-1-[4-(1,3,5-triazin-2-yl)-1-piperidinyl]-2-butanyl}-5-isoindolinecarboxamide [ACD/IUPAC Name]
2-(2-Chlorophényl)-1,3-dioxo-N-{1-oxo-1-[4-(1,3,5-triazin-2-yl)-1-pipéridinyl]-2-butanyl}-5-isoindolinecarboxamide [French] [ACD/IUPAC Name]
2-(2-Chlorphenyl)-1,3-dioxo-N-{1-oxo-1-[4-(1,3,5-triazin-2-yl)-1-piperidinyl]-2-butanyl}-5-isoindolincarboxamid [German] [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.645
Molar Refractivity: 137.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 0.91
ACD/LogD (pH 5.5): 1.64
ACD/BCF (pH 5.5): 10.44
ACD/KOC (pH 5.5): 186.47
ACD/LogD (pH 7.4): 1.64
ACD/BCF (pH 7.4): 10.44
ACD/KOC (pH 7.4): 186.57
Polar Surface Area: 125 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 67.9±3.0 dyne/cm
Molar Volume: 380.0±3.0 cm3

Click to predict properties on the Chemicalize site


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