ChemSpider 2D Image | (S)-vedaprofen | C19H22O2

(S)-vedaprofen

  • Molecular FormulaC19H22O2
  • Average mass282.377 Da
  • Monoisotopic mass282.161987 Da
  • ChemSpider ID30785829

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-(4-Cyclohexyl-1-naphthyl)propanoic acid [ACD/IUPAC Name]
(2S)-2-(4-Cyclohexyl-1-naphthyl)propansäure [German] [ACD/IUPAC Name]
(S)-vedaprofen
1-Naphthaleneacetic acid, 4-cyclohexyl-α-methyl-, (αS)- [ACD/Index Name]
242815-87-8 [RN]
Acide (2S)-2-(4-cyclohexyl-1-naphtyl)propanoïque [French] [ACD/IUPAC Name]
(S)-4-cyclohexyl-α-methyl-1-naphthaleneacetic acid
275-196-6 [EINECS]
71109-09-6 [RN]
UNII-OKX88EO7OI

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

5J802M3V7P [DBID]
  • Miscellaneous

    • Chemical Class:

      The <stereo>R</stereo>-enantiomer of the racemic drug vedaprofen. The racemate is used for control of pain and inflammation particularly associated with chronic musculoskeletal disorders and soft tiss ue trauma in dogs and horses and for treatment of pain due to horse colic. ChEBI CHEBI:76286
      The R-enantiomer of the racemic drug vedaprofen. The racemate is used for control of pain and inflammation particularly associated with chronic musculoskeletal disorders and soft tiss; ue trauma in do gs and horses and for treatment of pain due to horse colic. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:76286
      The R-enantiomer of the racemic drug vedaprofen. The racemate is used for control of pain and inflammation particularly associated with chronic musculoskeletal disorders and soft tissue trauma in dogs and horses and for treatment of pain due to horse colic. ChEBI CHEBI:76286

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

Density: 1.1±0.1 g/cm3
Boiling Point: 465.9±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.7±3.0 kJ/mol
Flash Point: 362.5±15.2 °C
Index of Refraction: 1.603
Molar Refractivity: 85.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.60
ACD/LogD (pH 5.5): 4.53
ACD/BCF (pH 5.5): 1099.49
ACD/KOC (pH 5.5): 3312.36
ACD/LogD (pH 7.4): 2.74
ACD/BCF (pH 7.4): 18.22
ACD/KOC (pH 7.4): 54.88
Polar Surface Area: 37 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 249.5±3.0 cm3

Click to predict properties on the Chemicalize site


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