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Search term: LACMSNCHWBQXEK-HXUWFJFHSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2R)-2-{[2-(3'-Chloro-2'-fluoro-4-biphenylyl)-3-cyano-1,7-naphthyridin-4-yl]amino}butanamide | C25H19ClFN5O

(2R)-2-{[2-(3'-Chloro-2'-fluoro-4-biphenylyl)-3-cyano-1,7-naphthyridin-4-yl]amino}butanamide

  • Molecular FormulaC25H19ClFN5O
  • Average mass459.903 Da
  • Monoisotopic mass459.126221 Da
  • ChemSpider ID129306854

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-{[2-(3'-Chlor-2'-fluor-4-biphenylyl)-3-cyan-1,7-naphthyridin-4-yl]amino}butanamid [German] [ACD/IUPAC Name]
(2R)-2-{[2-(3'-Chloro-2'-fluoro-4-biphenylyl)-3-cyano-1,7-naphthyridin-4-yl]amino}butanamide [ACD/IUPAC Name]
(2R)-2-{[2-(3'-Chloro-2'-fluoro-4-biphénylyl)-3-cyano-1,7-naphtyridin-4-yl]amino}butanamide [French] [ACD/IUPAC Name]
Butanamide, 2-[[2-(3'-chloro-2'-fluoro[1,1'-biphenyl]-4-yl)-3-cyano-1,7-naphthyridin-4-yl]amino]-, (2R)- [ACD/Index Name]
BAY-297

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

Density: 1.4±0.1 g/cm3
Boiling Point: 773.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.5±3.0 kJ/mol
Flash Point: 421.3±32.9 °C
Index of Refraction: 1.690
Molar Refractivity: 124.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.10
ACD/LogD (pH 5.5): 4.61
ACD/BCF (pH 5.5): 1886.77
ACD/KOC (pH 5.5): 7694.60
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1889.35
ACD/KOC (pH 7.4): 7705.11
Polar Surface Area: 105 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 74.0±5.0 dyne/cm
Molar Volume: 326.4±5.0 cm3

Click to predict properties on the Chemicalize site


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