Found 1 result

Search term: XGOZHCNNVCVDJO (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-{1-[3-(6,7-Difluoro-2-oxo-3,4-dihydro-1(2H)-quinolinyl)propyl]-4-piperidinyl}-2-(3,4-dimethoxyphenyl)acetamide | C27H33F2N3O4

N-{1-[3-(6,7-Difluoro-2-oxo-3,4-dihydro-1(2H)-quinolinyl)propyl]-4-piperidinyl}-2-(3,4-dimethoxyphenyl)acetamide

  • Molecular FormulaC27H33F2N3O4
  • Average mass501.565 Da
  • Monoisotopic mass501.243927 Da
  • ChemSpider ID26351529

More details:

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

Benzeneacetamide, N-[1-[3-(6,7-difluoro-3,4-dihydro-2-oxo-1(2H)-quinolinyl)propyl]-4-piperidinyl]-3,4-dimethoxy- [ACD/Index Name]
N-{1-[3-(6,7-Difluor-2-oxo-3,4-dihydro-1(2H)-chinolinyl)propyl]-4-piperidinyl}-2-(3,4-dimethoxyphenyl)acetamid [German] [ACD/IUPAC Name]
N-{1-[3-(6,7-Difluoro-2-oxo-3,4-dihydro-1(2H)-quinoléinyl)propyl]-4-pipéridinyl}-2-(3,4-diméthoxyphényl)acétamide [French] [ACD/IUPAC Name]
N-{1-[3-(6,7-Difluoro-2-oxo-3,4-dihydro-1(2H)-quinolinyl)propyl]-4-piperidinyl}-2-(3,4-dimethoxyphenyl)acetamide [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL1242979/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 746.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.8±3.0 kJ/mol
Flash Point: 405.2±32.9 °C
Index of Refraction: 1.591
Molar Refractivity: 132.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.96
ACD/LogD (pH 5.5): 0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.36
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 12.17
ACD/KOC (pH 7.4): 109.24
Polar Surface Area: 71 Å2
Polarizability: 52.4±0.5 10-24cm3
Surface Tension: 53.8±5.0 dyne/cm
Molar Volume: 390.9±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement