ChemSpider 2D Image | (5Z)-5-[2-Hydroxy-6-(4-nitrophenoxy)-4-oxo-2,5-cyclohexadien-1-ylidene]-N-(1-methyl-4-piperidinyl)-2,5-dihydro-1,2-oxazole-3-carboxamide | C22H22N4O7

(5Z)-5-[2-Hydroxy-6-(4-nitrophenoxy)-4-oxo-2,5-cyclohexadien-1-ylidene]-N-(1-methyl-4-piperidinyl)-2,5-dihydro-1,2-oxazole-3-carboxamide

  • Molecular FormulaC22H22N4O7
  • Average mass454.433 Da
  • Monoisotopic mass454.148834 Da
  • ChemSpider ID32821811

  • Double-bond stereo - Double-bond stereo

More details:

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

(5Z)-5-[2-Hydroxy-6-(4-nitrophenoxy)-4-oxo-2,5-cyclohexadien-1-yliden]-N-(1-methyl-4-piperidinyl)-2,5-dihydro-1,2-oxazol-3-carboxamid [German] [ACD/IUPAC Name]
(5Z)-5-[2-Hydroxy-6-(4-nitrophenoxy)-4-oxo-2,5-cyclohexadien-1-ylidene]-N-(1-methyl-4-piperidinyl)-2,5-dihydro-1,2-oxazole-3-carboxamide [ACD/IUPAC Name]
(5Z)-5-[2-Hydroxy-6-(4-nitrophénoxy)-4-oxo-2,5-cyclohexadién-1-ylidène]-N-(1-méthyl-4-pipéridinyl)-2,5-dihydro-1,2-oxazole-3-carboxamide [French] [ACD/IUPAC Name]
3-Isoxazolecarboxamide, 2,5-dihydro-5-[2-hydroxy-6-(4-nitrophenoxy)-4-oxo-2,5-cyclohexadien-1-ylidene]-N-(1-methyl-4-piperidinyl)-, (5Z)- [ACD/Index Name]
1253584-84-7 [RN]
NMS-E973

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.685
Molar Refractivity: 115.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.62
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): -1.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 45.9±0.5 10-24cm3
Surface Tension: 74.6±5.0 dyne/cm
Molar Volume: 304.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement