ChemSpider 2D Image | N-{1-[(2Z)-2-(3-Ethoxy-4-{2-oxo-2-[(2-phenylethyl)amino]ethoxy}benzylidene)hydrazino]-4-(methylsulfanyl)-1-oxo-2-butanyl}-4-(trifluoromethyl)benzamide (non-preferred name) | C32H35F3N4O5S

N-{1-[(2Z)-2-(3-Ethoxy-4-{2-oxo-2-[(2-phenylethyl)amino]ethoxy}benzylidene)hydrazino]-4-(methylsulfanyl)-1-oxo-2-butanyl}-4-(trifluoromethyl)benzamide (non-preferred name)

  • Molecular FormulaC32H35F3N4O5S
  • Average mass644.704 Da
  • Monoisotopic mass644.228027 Da
  • ChemSpider ID101962128

  • Double-bond stereo - Double-bond stereo

More details:

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

N-{1-[(2Z)-2-(3-Ethoxy-4-{2-oxo-2-[(2-phenylethyl)amino]ethoxy}benzyliden)hydrazino]-4-(methylsulfanyl)-1-oxo-2-butanyl}-4-(trifluormethyl)benzamid (non-preferred name) [German] [ACD/IUPAC Name]
N-{1-[(2Z)-2-(3-Ethoxy-4-{2-oxo-2-[(2-phenylethyl)amino]ethoxy}benzylidene)hydrazino]-4-(methylsulfanyl)-1-oxo-2-butanyl}-4-(trifluoromethyl)benzamide (non-preferred name) [ACD/IUPAC Name]
N-{1-[(2Z)-2-(3-Éthoxy-4-{2-oxo-2-[(2-phényléthyl)amino]éthoxy}benzylidène)hydrazino]-4-(méthylsulfanyl)-1-oxo-2-butanyl}-4-(trifluorométhyl)benzamide (non-preferred name) [French] [ACD/IUPAC Name]

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: 1.569
Molar Refractivity: 167.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 2
ACD/LogP: 6.84
ACD/LogD (pH 5.5): 5.26
ACD/BCF (pH 5.5): 5884.89
ACD/KOC (pH 5.5): 17376.82
ACD/LogD (pH 7.4): 5.26
ACD/BCF (pH 7.4): 5884.63
ACD/KOC (pH 7.4): 17376.03
Polar Surface Area: 143 Å2
Polarizability: 66.4±0.5 10-24cm3
Surface Tension: 43.0±7.0 dyne/cm
Molar Volume: 511.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement