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Search term: XXWKAPSDJYNICL-SVBPBHIXSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(3-{3-[(3S,4S)-4-(2,5-Dimethyl-1H-benzimidazol-1-yl)-3-methoxy-1-piperidinyl]propyl}phenyl)cyclopropanecarboxamide | C28H36N4O2

N-(3-{3-[(3S,4S)-4-(2,5-Dimethyl-1H-benzimidazol-1-yl)-3-methoxy-1-piperidinyl]propyl}phenyl)cyclopropanecarboxamide

  • Molecular FormulaC28H36N4O2
  • Average mass460.611 Da
  • Monoisotopic mass460.283813 Da
  • ChemSpider ID23323105

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Cyclopropanecarboxamide, N-[3-[3-[(3S,4S)-4-(2,5-dimethyl-1H-benzimidazol-1-yl)-3-methoxy-1-piperidinyl]propyl]phenyl]- [ACD/Index Name]
N-(3-{3-[(3S,4S)-4-(2,5-Dimethyl-1H-benzimidazol-1-yl)-3-methoxy-1-piperidinyl]propyl}phenyl)cyclopropancarboxamid [German] [ACD/IUPAC Name]
N-(3-{3-[(3S,4S)-4-(2,5-Dimethyl-1H-benzimidazol-1-yl)-3-methoxy-1-piperidinyl]propyl}phenyl)cyclopropanecarboxamide [ACD/IUPAC Name]
N-(3-{3-[(3S,4S)-4-(2,5-Diméthyl-1H-benzimidazol-1-yl)-3-méthoxy-1-pipéridinyl]propyl}phényl)cyclopropanecarboxamide [French] [ACD/IUPAC Name]
N-(3-{3-[(3S,4S)-4-(2,5-dimethyl-1H-benzimidazol-1-yl)-3-methoxypiperidin-1-yl]propyl}phenyl)cyclopropanecarboxamide
N-(3-(3-((3S,4S)-4-(2,5-dimethyl-1H-benzo[d]imidazol-1-yl)-3-methoxypiperidin-1-yl)propyl)phenyl)cyclopropanecarboxamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 692.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 372.7±31.5 °C
Index of Refraction: 1.642
Molar Refractivity: 134.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.32
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 1.23
ACD/KOC (pH 5.5): 6.06
ACD/LogD (pH 7.4): 3.58
ACD/BCF (pH 7.4): 213.33
ACD/KOC (pH 7.4): 1052.32
Polar Surface Area: 59 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 46.3±7.0 dyne/cm
Molar Volume: 372.5±7.0 cm3

Click to predict properties on the Chemicalize site


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