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Search term: MF = 'C_{32}H_{36}N_{4}O'
ChemSpider 2D Image | TCMDC-140456 | C32H36N4O

TCMDC-140456

  • Molecular FormulaC32H36N4O
  • Average mass492.654 Da
  • Monoisotopic mass492.288910 Da
  • ChemSpider ID24580136

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-N-(1-Benzyl-4-piperidinyl)-3-{4-[5-(2-methyl-2-propanyl)-1H-benzimidazol-2-yl]phenyl}acrylamid [German] [ACD/IUPAC Name]
(2E)-N-(1-Benzyl-4-piperidinyl)-3-{4-[5-(2-methyl-2-propanyl)-1H-benzimidazol-2-yl]phenyl}acrylamide [ACD/IUPAC Name]
(2E)-N-(1-Benzyl-4-pipéridinyl)-3-{4-[5-(2-méthyl-2-propanyl)-1H-benzimidazol-2-yl]phényl}acrylamide [French] [ACD/IUPAC Name]
(2E)-N-(1-Benzylpiperidin-4-yl)-3-[4-(5-tert-butyl-1H-benzimidazol-2-yl)phenyl]acrylamide
2-Propenamide, 3-[4-[5-(1,1-dimethylethyl)-1H-benzimidazol-2-yl]phenyl]-N-[1-(phenylmethyl)-4-piperidinyl]-, (2E)- [ACD/Index Name]
TCMDC-140456
  • Miscellaneous

    • Bio Activity:

      XC50_3D7 (uM) (Plasmodium Falciparum, Malaria): 0.589210725 GlaxoSmithKline Malaria Set

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.655
Molar Refractivity: 151.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.19
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 46.33
ACD/KOC (pH 5.5): 103.32
ACD/LogD (pH 7.4): 5.21
ACD/BCF (pH 7.4): 3781.73
ACD/KOC (pH 7.4): 8432.67
Polar Surface Area: 61 Å2
Polarizability: 59.9±0.5 10-24cm3
Surface Tension: 59.3±5.0 dyne/cm
Molar Volume: 411.7±5.0 cm3

Click to predict properties on the Chemicalize site


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