ChemSpider 2D Image | N-{(1E)-3-{(2E)-2-[(3E)-4-(1,3-Benzodioxol-5-yl)-3-buten-2-ylidene]hydrazino}-1-[4-(diethylamino)phenyl]-3-oxo-1-propen-2-yl}benzamide | C31H32N4O4

N-{(1E)-3-{(2E)-2-[(3E)-4-(1,3-Benzodioxol-5-yl)-3-buten-2-ylidene]hydrazino}-1-[4-(diethylamino)phenyl]-3-oxo-1-propen-2-yl}benzamide

  • Molecular FormulaC31H32N4O4
  • Average mass524.610 Da
  • Monoisotopic mass524.242371 Da
  • ChemSpider ID21810822
  • Double-bond stereo - Double-bond stereo


More details:






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

2-Propenoic acid, 2-(benzoylamino)-3-[4-(diethylamino)phenyl]-, 2-[(1E,2E)-3-(1,3-benzodioxol-5-yl)-1-methyl-2-propen-1-ylidene]hydrazide, (2E)- [ACD/Index Name]
N-{(1E)-3-{(2E)-2-[(3E)-4-(1,3-Benzodioxol-5-yl)-3-buten-2-yliden]hydrazino}-1-[4-(diethylamino)phenyl]-3-oxo-1-propen-2-yl}benzamid [German] [ACD/IUPAC Name]
N-{(1E)-3-{(2E)-2-[(3E)-4-(1,3-Benzodioxol-5-yl)-3-buten-2-ylidene]hydrazino}-1-[4-(diethylamino)phenyl]-3-oxo-1-propen-2-yl}benzamide [ACD/IUPAC Name]
N-{(1E)-3-{(2E)-2-[(3E)-4-(1,3-Benzodioxol-5-yl)-3-butén-2-ylidène]hydrazino}-1-[4-(diéthylamino)phényl]-3-oxo-1-propén-2-yl}benzamide [French] [ACD/IUPAC Name]
N-{(1E)-3-{(2E)-2-[(3E)-4-(1,3-Benzodioxol-5-yl)but-3-en-2-ylidene]hydrazino}-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl}benzamide
N-[1-(3-Benzo[1,3]dioxol-5-yl-1-methyl-allylidene-hydrazinocarbonyl)-2-(4-diethylamino-phenyl)-vinyl]-benzamide
N-{(1E)-3-{(2E)-2-[(3E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-ylidene]hydrazinyl}-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl}benzamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.597
Molar Refractivity: 152.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.89
ACD/LogD (pH 5.5): 5.02
ACD/BCF (pH 5.5): 3347.81
ACD/KOC (pH 5.5): 9846.10
ACD/LogD (pH 7.4): 5.27
ACD/BCF (pH 7.4): 5908.54
ACD/KOC (pH 7.4): 17377.33
Polar Surface Area: 92 Å2
Polarizability: 60.4±0.5 10-24cm3
Surface Tension: 44.3±7.0 dyne/cm
Molar Volume: 446.7±7.0 cm3

Click to predict properties on the Chemicalize site






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