ChemSpider 2D Image | N-{2-[(3,4-Difluorophenyl)amino]-2-oxoethyl}-9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline-6-carboxamide | C20H16F2N4O3

N-{2-[(3,4-Difluorophenyl)amino]-2-oxoethyl}-9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline-6-carboxamide

  • Molecular FormulaC20H16F2N4O3
  • Average mass398.363 Da
  • Monoisotopic mass398.119049 Da
  • ChemSpider ID21988600

More details:

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

N-{2-[(3,4-Difluorophenyl)amino]-2-oxoethyl}-9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline-6-carboxamide [ACD/IUPAC Name]
N-{2-[(3,4-Difluorophényl)amino]-2-oxoéthyl}-9-oxo-1,2,3,9-tétrahydropyrrolo[2,1-b]quinazoline-6-carboxamide [French] [ACD/IUPAC Name]
N-{2-[(3,4-Difluorphenyl)amino]-2-oxoethyl}-9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]chinazolin-6-carboxamid [German] [ACD/IUPAC Name]
Pyrrolo[2,1-b]quinazoline-6-carboxamide, N-[2-[(3,4-difluorophenyl)amino]-2-oxoethyl]-1,2,3,9-tetrahydro-9-oxo- [ACD/Index Name]

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: 1.685
Molar Refractivity: 99.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.44
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 4.17
ACD/KOC (pH 5.5): 96.72
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 4.17
ACD/KOC (pH 7.4): 96.74
Polar Surface Area: 91 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 55.7±7.0 dyne/cm
Molar Volume: 262.9±7.0 cm3

Click to predict properties on the Chemicalize site


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