ChemSpider 2D Image | 1-[5-Chloro-2-(3-pyrrolidinyloxy)phenyl]-3-(5-cyano-2-pyrazinyl)urea | C16H15ClN6O2

1-[5-Chloro-2-(3-pyrrolidinyloxy)phenyl]-3-(5-cyano-2-pyrazinyl)urea

  • Molecular FormulaC16H15ClN6O2
  • Average mass358.782 Da
  • Monoisotopic mass358.094513 Da
  • ChemSpider ID24624490

More details:

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

1-[5-Chlor-2-(3-pyrrolidinyloxy)phenyl]-3-(5-cyan-2-pyrazinyl)harnstoff [German] [ACD/IUPAC Name]
1-[5-Chloro-2-(3-pyrrolidinyloxy)phenyl]-3-(5-cyano-2-pyrazinyl)urea [ACD/IUPAC Name]
1-[5-Chloro-2-(3-pyrrolidinyloxy)phényl]-3-(5-cyano-2-pyrazinyl)urée [French] [ACD/IUPAC Name]
Urea, N-[5-chloro-2-(3-pyrrolidinyloxy)phenyl]-N'-(5-cyano-2-pyrazinyl)- [ACD/Index Name]
Chk1_19

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

Density: 1.5±0.1 g/cm3
Boiling Point: 486.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.2±3.0 kJ/mol
Flash Point: 248.1±28.7 °C
Index of Refraction: 1.657
Molar Refractivity: 90.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.18
ACD/LogD (pH 5.5): -1.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.60
Polar Surface Area: 112 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 78.2±5.0 dyne/cm
Molar Volume: 245.7±5.0 cm3

Click to predict properties on the Chemicalize site


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