ChemSpider 2D Image | N-[3-(5-{[1-{4-[3-(Dimethylamino)propoxy]phenyl}-2-oxo-2-(1-piperazinyl)ethyl]carbamoyl}-2-furyl)phenyl]-2-pyridinecarboxamide | C34H38N6O5

N-[3-(5-{[1-{4-[3-(Dimethylamino)propoxy]phenyl}-2-oxo-2-(1-piperazinyl)ethyl]carbamoyl}-2-furyl)phenyl]-2-pyridinecarboxamide

  • Molecular FormulaC34H38N6O5
  • Average mass610.703 Da
  • Monoisotopic mass610.290344 Da
  • ChemSpider ID23251185

More details:

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

2-Pyridinecarboxamide, N-[3-[5-[[[1-[4-[3-(dimethylamino)propoxy]phenyl]-2-oxo-2-(1-piperazinyl)ethyl]amino]carbonyl]-2-furanyl]phenyl]- [ACD/Index Name]
N-[3-(5-{[1-{4-[3-(Dimethylamino)propoxy]phenyl}-2-oxo-2-(1-piperazinyl)ethyl]carbamoyl}-2-furyl)phenyl]-2-pyridincarboxamid [German] [ACD/IUPAC Name]
N-[3-(5-{[1-{4-[3-(Dimethylamino)propoxy]phenyl}-2-oxo-2-(1-piperazinyl)ethyl]carbamoyl}-2-furyl)phenyl]-2-pyridinecarboxamide [ACD/IUPAC Name]
N-[3-(5-{[1-{4-[3-(Diméthylamino)propoxy]phényl}-2-oxo-2-(1-pipérazinyl)éthyl]carbamoyl}-2-furyl)phényl]-2-pyridinecarboxamide [French] [ACD/IUPAC Name]
N-[3-(5-{[1-{4-[3-(dimethylamino)propoxy]phenyl}-2-oxo-2-(piperazin-1-yl)ethyl]carbamoyl}furan-2-yl)phenyl]pyridine-2-carboxamide
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL363914/
Pyridine-2-carboxylic acid [3-(5-{1-[4-(3-dimethylamino-propoxy)-phenyl]-2-oxo-2-piperazin-1-yl-ethylcarbamoyl}-furan-2-yl)-phenyl]-amide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 789.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 114.9±3.0 kJ/mol
Flash Point: 431.4±32.9 °C
Index of Refraction: 1.616
Molar Refractivity: 170.7±0.3 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 2.44
ACD/LogD (pH 5.5): -1.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.79
Polar Surface Area: 129 Å2
Polarizability: 67.7±0.5 10-24cm3
Surface Tension: 55.5±3.0 dyne/cm
Molar Volume: 488.4±3.0 cm3

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