ChemSpider 2D Image | 4-({5-Chloro-4-[(2-methyl-3-oxo-2,3-dihydro-1H-isoindol-4-yl)oxy]-2-pyrimidinyl}amino)-5-methoxy-2-methyl-N-(1-methyl-4-piperidinyl)benzamide | C28H31ClN6O4

4-({5-Chloro-4-[(2-methyl-3-oxo-2,3-dihydro-1H-isoindol-4-yl)oxy]-2-pyrimidinyl}amino)-5-methoxy-2-methyl-N-(1-methyl-4-piperidinyl)benzamide

  • Molecular FormulaC28H31ClN6O4
  • Average mass551.036 Da
  • Monoisotopic mass550.209534 Da
  • ChemSpider ID58956431

More details:

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

4-({5-Chlor-4-[(2-methyl-3-oxo-2,3-dihydro-1H-isoindol-4-yl)oxy]-2-pyrimidinyl}amino)-5-methoxy-2-methyl-N-(1-methyl-4-piperidinyl)benzamid [German] [ACD/IUPAC Name]
4-({5-Chloro-4-[(2-methyl-3-oxo-2,3-dihydro-1H-isoindol-4-yl)oxy]-2-pyrimidinyl}amino)-5-methoxy-2-methyl-N-(1-methyl-4-piperidinyl)benzamide [ACD/IUPAC Name]
4-({5-Chloro-4-[(2-méthyl-3-oxo-2,3-dihydro-1H-isoindol-4-yl)oxy]-2-pyrimidinyl}amino)-5-méthoxy-2-méthyl-N-(1-méthyl-4-pipéridinyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-[[5-chloro-4-[(2,3-dihydro-2-methyl-3-oxo-1H-isoindol-4-yl)oxy]-2-pyrimidinyl]amino]-5-methoxy-2-methyl-N-(1-methyl-4-piperidinyl)- [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: 1.666
Molar Refractivity: 146.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 1.53
ACD/LogD (pH 5.5): 0.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.05
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 9.85
ACD/KOC (pH 7.4): 87.35
Polar Surface Area: 109 Å2
Polarizability: 58.2±0.5 10-24cm3
Surface Tension: 71.8±5.0 dyne/cm
Molar Volume: 394.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement