ChemSpider 2D Image | Osanetant | C35H41Cl2N3O2

Osanetant

  • Molecular FormulaC35H41Cl2N3O2
  • Average mass606.625 Da
  • Monoisotopic mass605.257568 Da
  • ChemSpider ID189901
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

160492-56-8 [RN]
7460
Acetamide, N-[1-[3-[(3R)-1-benzoyl-3-(3,4-dichlorophenyl)-3-piperidinyl]propyl]-4-phenyl-4-piperidinyl]-N-methyl- [ACD/Index Name]
K7G81N94DT
N-(1-{3-[(3R)-1-Benzoyl-3-(3,4-dichlorophenyl)-3-piperidinyl]propyl}-4-phenyl-4-piperidinyl)-N-methylacetamide [ACD/IUPAC Name]
N-(1-{3-[(3R)-1-Benzoyl-3-(3,4-dichlorophényl)-3-pipéridinyl]propyl}-4-phényl-4-pipéridinyl)-N-méthylacétamide [French] [ACD/IUPAC Name]
n-(1-{3-[(3r)-1-benzoyl-3-(3,4-dichlorophenyl)piperidin-3-yl]propyl}-4-phenylpiperidin-4-yl)-n-methylacetamide
N-(1-{3-[(3R)-1-Benzoyl-3-(3,4-dichlorphenyl)-3-piperidinyl]propyl}-4-phenyl-4-piperidinyl)-N-methylacetamid [German] [ACD/IUPAC Name]
(R)-N-(1-(3-(1-benzoyl-3-(3,4-dichlorophenyl)piperidin-3-yl)propyl)-4-phenylpiperidin-4-yl)-N-methylacetamide
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Safety:

      5 Axon Medchem 1533
      H303;H313;H317;H333;H334;H335;H373 Axon Medchem 1533
      no pictogram Axon Medchem 1533
      P101;P102;P103;P260;P262;P263;P264;P270;P280;P304;P312;P340 Axon Medchem 1533
      Warning Axon Medchem 1533

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 727.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.3±3.0 kJ/mol
Flash Point: 394.0±32.9 °C
Index of Refraction: 1.633
Molar Refractivity: 172.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.79
ACD/LogD (pH 5.5): 3.46
ACD/BCF (pH 5.5): 68.46
ACD/KOC (pH 5.5): 152.51
ACD/LogD (pH 7.4): 5.17
ACD/BCF (pH 7.4): 3488.94
ACD/KOC (pH 7.4): 7772.01
Polar Surface Area: 44 Å2
Polarizability: 68.3±0.5 10-24cm3
Surface Tension: 57.7±5.0 dyne/cm
Molar Volume: 482.4±5.0 cm3

Click to predict properties on the Chemicalize site





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