ChemSpider 2D Image | (5Z)-7-{(1R,2R,3S,5S)-3,5-Dihydroxy-2-[(1E)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-N-ethyl-5-heptenamide | C25H37NO4

(5Z)-7-{(1R,2R,3S,5S)-3,5-Dihydroxy-2-[(1E)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-N-ethyl-5-heptenamide

  • Molecular FormulaC25H37NO4
  • Average mass415.566 Da
  • Monoisotopic mass415.272247 Da
  • ChemSpider ID24747372

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(5Z)-7-{(1R,2R,3S,5S)-3,5-Dihydroxy-2-[(1E)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-N-ethyl-5-heptenamid [German] [ACD/IUPAC Name]
(5Z)-7-{(1R,2R,3S,5S)-3,5-Dihydroxy-2-[(1E)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl}-N-ethyl-5-heptenamide [ACD/IUPAC Name]
(5Z)-7-{(1R,2R,3S,5S)-3,5-Dihydroxy-2-[(1E)-3-hydroxy-5-phényl-1-pentén-1-yl]cyclopentyl}-N-éthyl-5-hepténamide [French] [ACD/IUPAC Name]
5-Heptenamide, 7-[(1R,2R,3S,5S)-3,5-dihydroxy-2-[(1E)-3-hydroxy-5-phenyl-1-penten-1-yl]cyclopentyl]-N-ethyl-, (5Z)- [ACD/Index Name]
155206-00-1 [RN]
5-Heptenamide, 7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenyl-1-pente nyl]cyclopentyl]-N-ethyl-, (5Z)-
Bimatoprost [USAN] [Wiki]
Lumigan [Trade name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 629.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 334.7±31.5 °C
Index of Refraction: 1.591
Molar Refractivity: 122.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 1.98
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 37.24
ACD/KOC (pH 5.5): 463.61
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 37.24
ACD/KOC (pH 7.4): 463.61
Polar Surface Area: 90 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 362.8±3.0 cm3

Click to predict properties on the Chemicalize site


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