ChemSpider 2D Image | 1-(5-Cyano-2-pyridinyl)-3-[(1S,2R)-2-(6-fluoro-2-hydroxy-3-propionylphenyl)cyclopropyl]urea | C19H17FN4O3

1-(5-Cyano-2-pyridinyl)-3-[(1S,2R)-2-(6-fluoro-2-hydroxy-3-propionylphenyl)cyclopropyl]urea

  • Molecular FormulaC19H17FN4O3
  • Average mass368.362 Da
  • Monoisotopic mass368.128479 Da
  • ChemSpider ID62468181

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-(5-Cyan-2-pyridinyl)-3-[(1S,2R)-2-(6-fluor-2-hydroxy-3-propionylphenyl)cyclopropyl]harnstoff [German] [ACD/IUPAC Name]
1-(5-Cyano-2-pyridinyl)-3-[(1S,2R)-2-(6-fluoro-2-hydroxy-3-propionylphenyl)cyclopropyl]urea [ACD/IUPAC Name]
1-(5-Cyano-2-pyridinyl)-3-[(1S,2R)-2-(6-fluoro-2-hydroxy-3-propionylphényl)cyclopropyl]urée [French] [ACD/IUPAC Name]
1-[(2Z)-5-Cyan-2(1H)-pyridinyliden]-3-[(1S,2R)-2-(6-fluor-2-hydroxy-3-propionylphenyl)cyclopropyl]harnstoff [German] [ACD/IUPAC Name]
1-[(2Z)-5-Cyano-2(1H)-pyridinylidene]-3-[(1S,2R)-2-(6-fluoro-2-hydroxy-3-propionylphenyl)cyclopropyl]urea [ACD/IUPAC Name]
1-[(2Z)-5-Cyano-2(1H)-pyridinylidène]-3-[(1S,2R)-2-(6-fluoro-2-hydroxy-3-propionylphényl)cyclopropyl]urée [French] [ACD/IUPAC Name]
Urea, N-(5-cyano-2-pyridinyl)-N'-[(1S,2R)-2-[6-fluoro-2-hydroxy-3-(1-oxopropyl)phenyl]cyclopropyl]- [ACD/Index Name]
Urea, N-[(2Z)-5-cyano-2(1H)-pyridinylidene]-N'-[(1S,2R)-2-[6-fluoro-2-hydroxy-3-(1-oxopropyl)phenyl]cyclopropyl]- [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: 95.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.03
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 6.03
ACD/KOC (pH 5.5): 80.68
ACD/LogD (pH 7.4): 1.92
ACD/BCF (pH 7.4): 14.33
ACD/KOC (pH 7.4): 191.68
Polar Surface Area: 115 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 54.4±7.0 dyne/cm
Molar Volume: 257.6±7.0 cm3

Click to predict properties on the Chemicalize site


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