ChemSpider 2D Image | 5-{[2-Chloro-6-(4-pyridinyl)-4-pyrimidinyl]amino}-1H-isoindole-1,3(2H)-dione | C17H10ClN5O2

5-{[2-Chloro-6-(4-pyridinyl)-4-pyrimidinyl]amino}-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC17H10ClN5O2
  • Average mass351.747 Da
  • Monoisotopic mass351.052307 Da
  • ChemSpider ID29306131

More details:

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

1H-Isoindole-1,3(2H)-dione, 5-[[2-chloro-6-(4-pyridinyl)-4-pyrimidinyl]amino]- [ACD/Index Name]
5-{[2-Chlor-6-(4-pyridinyl)-4-pyrimidinyl]amino}-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
5-{[2-Chloro-6-(4-pyridinyl)-4-pyrimidinyl]amino}-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
5-{[2-Chloro-6-(4-pyridinyl)-4-pyrimidinyl]amino}-1H-isoindole-1,3(2H)-dione [French] [ACD/IUPAC Name]
5-{[2-chloro-6-(pyridin-4-yl)pyrimidin-4-yl]amino}-1H-isoindole-1,3(2H)-dione

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.715
Molar Refractivity: 90.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 23.68
ACD/KOC (pH 5.5): 335.32
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 23.56
ACD/KOC (pH 7.4): 333.48
Polar Surface Area: 97 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 79.0±3.0 dyne/cm
Molar Volume: 230.5±3.0 cm3

Click to predict properties on the Chemicalize site


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