ChemSpider 2D Image | MFCD03417064 | C30H23N7O4

MFCD03417064

  • Molecular FormulaC30H23N7O4
  • Average mass545.548 Da
  • Monoisotopic mass545.181152 Da
  • ChemSpider ID4800269

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-Cyan-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]acrylamid [German] [ACD/IUPAC Name]
(2E)-2-CYANO-N-(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL)-3-[3-(4-NITROPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]-2-PROPENAMIDE
(2E)-2-Cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]acrylamide [ACD/IUPAC Name]
(2E)-2-Cyano-N-(1,5-diméthyl-3-oxo-2-phényl-2,3-dihydro-1H-pyrazol-4-yl)-3-[3-(4-nitrophényl)-1-phényl-1H-pyrazol-4-yl]acrylamide [French] [ACD/IUPAC Name]
2-Propenamide, 2-cyano-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-3-[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-, (2E)- [ACD/Index Name]
MFCD03417064
(2E)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enamide
(2E)-N-(2,3-dimethyl-5-oxo-1-phenyl(3-pyrazolin-4-yl))-2-cyano-3-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]prop-2-enamide
(E)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]prop-2-enamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.683
Molar Refractivity: 154.9±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 3.23
ACD/LogD (pH 5.5): 3.31
ACD/BCF (pH 5.5): 194.42
ACD/KOC (pH 5.5): 1512.88
ACD/LogD (pH 7.4): 3.29
ACD/BCF (pH 7.4): 185.46
ACD/KOC (pH 7.4): 1443.16
Polar Surface Area: 140 Å2
Polarizability: 61.4±0.5 10-24cm3
Surface Tension: 58.3±7.0 dyne/cm
Molar Volume: 408.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement