ChemSpider 2D Image | (4E)-N-Hydroxy-6-[3-(4-morpholinyl)propyl]-2-(thieno[3,2-c]pyridin-6-yl)-4H-chromen-4-imine | C23H23N3O3S

(4E)-N-Hydroxy-6-[3-(4-morpholinyl)propyl]-2-(thieno[3,2-c]pyridin-6-yl)-4H-chromen-4-imine

  • Molecular FormulaC23H23N3O3S
  • Average mass421.512 Da
  • Monoisotopic mass421.146027 Da
  • ChemSpider ID59718537

More details:

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

(4E)-N-Hydroxy-6-[3-(4-morpholinyl)propyl]-2-(thieno[3,2-c]pyridin-6-yl)-4H-chromen-4-imin [German] [ACD/IUPAC Name]
(4E)-N-Hydroxy-6-[3-(4-morpholinyl)propyl]-2-(thieno[3,2-c]pyridin-6-yl)-4H-chromen-4-imine [ACD/IUPAC Name]
(4E)-N-Hydroxy-6-[3-(4-morpholinyl)propyl]-2-(thiéno[3,2-c]pyridin-6-yl)-4H-chromén-4-imine [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 6-[3-(4-morpholinyl)propyl]-2-thieno[3,2-c]pyridin-6-yl-, oxime, (4E)- [ACD/Index Name]
DT1687
foliglurax (proposed INN)
PXT002331
PXT-002331

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

Density: 1.4±0.1 g/cm3
Boiling Point: 646.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.3±3.0 kJ/mol
Flash Point: 345.0±31.5 °C
Index of Refraction: 1.696
Molar Refractivity: 117.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.81
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 1.64
ACD/KOC (pH 5.5): 11.80
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 124.61
ACD/KOC (pH 7.4): 896.11
Polar Surface Area: 95 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 56.3±7.0 dyne/cm
Molar Volume: 305.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement