ChemSpider 2D Image | 2-Chloro-3-(1-cyanocyclopropyl)-N-{3-[2,6-di(4-morpholinyl)-4-pyrimidinyl]-4-methylphenyl}benzamide | C30H31ClN6O3

2-Chloro-3-(1-cyanocyclopropyl)-N-{3-[2,6-di(4-morpholinyl)-4-pyrimidinyl]-4-methylphenyl}benzamide

  • Molecular FormulaC30H31ClN6O3
  • Average mass559.058 Da
  • Monoisotopic mass558.214600 Da
  • ChemSpider ID76727589

More details:

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

2-Chlor-3-(1-cyancyclopropyl)-N-{3-[2,6-di(4-morpholinyl)-4-pyrimidinyl]-4-methylphenyl}benzamid [German] [ACD/IUPAC Name]
2-Chloro-3-(1-cyanocyclopropyl)-N-{3-[2,6-di(4-morpholinyl)-4-pyrimidinyl]-4-methylphenyl}benzamide [ACD/IUPAC Name]
2-Chloro-3-(1-cyanocyclopropyl)-N-{3-[2,6-di(4-morpholinyl)-4-pyrimidinyl]-4-méthylphényl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 2-chloro-3-(1-cyanocyclopropyl)-N-[3-(2,6-di-4-morpholinyl-4-pyrimidinyl)-4-methylphenyl]- [ACD/Index 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: 1.680
Molar Refractivity: 150.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.93
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 1.43
ACD/KOC (pH 5.5): 9.01
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 11.32
ACD/KOC (pH 7.4): 71.16
Polar Surface Area: 104 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 76.5±5.0 dyne/cm
Molar Volume: 397.5±5.0 cm3

Click to predict properties on the Chemicalize site


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