ChemSpider 2D Image | N-[2-(Dimethylamino)ethyl]-4-{2-[(3-fluorophenyl)amino]-4-pyrimidinyl}benzamide | C21H22FN5O

N-[2-(Dimethylamino)ethyl]-4-{2-[(3-fluorophenyl)amino]-4-pyrimidinyl}benzamide

  • Molecular FormulaC21H22FN5O
  • Average mass379.431 Da
  • Monoisotopic mass379.180847 Da
  • ChemSpider ID24809013

More details:

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

Benzamide, N-[2-(dimethylamino)ethyl]-4-[2-[(3-fluorophenyl)amino]-4-pyrimidinyl]- [ACD/Index Name]
N-[2-(Dimethylamino)ethyl]-4-{2-[(3-fluorophenyl)amino]-4-pyrimidinyl}benzamide [ACD/IUPAC Name]
N-[2-(Diméthylamino)éthyl]-4-{2-[(3-fluorophényl)amino]-4-pyrimidinyl}benzamide [French] [ACD/IUPAC Name]
N-[2-(Dimethylamino)ethyl]-4-{2-[(3-fluorphenyl)amino]-4-pyrimidinyl}benzamid [German] [ACD/IUPAC Name]
Kinome_757

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.615
Molar Refractivity: 107.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.76
ACD/LogD (pH 5.5): 0.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.98
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 41.88
ACD/KOC (pH 7.4): 347.18
Polar Surface Area: 70 Å2
Polarizability: 42.7±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 308.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement