ChemSpider 2D Image | N-{(E)-[1-(3,4-Dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2-[(phenylsulfonyl)(3-pyridinyl)amino]ethanehydrazonic acid | C26H23Cl2N5O3S

N-{(E)-[1-(3,4-Dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2-[(phenylsulfonyl)(3-pyridinyl)amino]ethanehydrazonic acid

  • Molecular FormulaC26H23Cl2N5O3S
  • Average mass556.464 Da
  • Monoisotopic mass555.089844 Da
  • ChemSpider ID57257528

  • Double-bond stereo - Double-bond stereo

More details:

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

Acide N-{(E)-[1-(3,4-dichlorophényl)-2,5-diméthyl-1H-pyrrol-3-yl]méthylène}-2-[(phénylsulfonyl)(3-pyridinyl)amino]éthanehydrazonique [French] [ACD/IUPAC Name]
Ethanehydrazonic acid, N-[(1E)-[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene]-2-[(phenylsulfonyl)-3-pyridinylamino]- [ACD/Index Name]
N-{(E)-[1-(3,4-Dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2-[(phenylsulfonyl)(3-pyridinyl)amino]ethanehydrazonic acid [ACD/IUPAC Name]
N-{(E)-[1-(3,4-Dichlorphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylen}-2-[(phenylsulfonyl)(3-pyridinyl)amino]ethanhydrazonsäure [German] [ACD/IUPAC Name]
2-[BENZENESULFONYL(PYRIDIN-3-YL)AMINO]-N-[(E)-[1-(3,4-DICHLOROPHENYL)-2,5-DIMETHYLPYRROL-3-YL]METHYLIDENEAMINO]ACETAMIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 754.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.3±3.0 kJ/mol
Flash Point: 409.9±35.7 °C
Index of Refraction: 1.652
Molar Refractivity: 148.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.66
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 60.90
ACD/KOC (pH 5.5): 195.37
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 62.58
ACD/KOC (pH 7.4): 200.77
Polar Surface Area: 109 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 52.8±7.0 dyne/cm
Molar Volume: 406.7±7.0 cm3

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