ChemSpider 2D Image | 3,5-Dibromo-2-methoxy-N-{[2-(1-pyrrolidinyl)phenyl]carbamothioyl}benzamide | C19H19Br2N3O2S

3,5-Dibromo-2-methoxy-N-{[2-(1-pyrrolidinyl)phenyl]carbamothioyl}benzamide

  • Molecular FormulaC19H19Br2N3O2S
  • Average mass513.246 Da
  • Monoisotopic mass510.956451 Da
  • ChemSpider ID3698534

More details:

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

3,5-Dibrom-2-methoxy-N-{[2-(1-pyrrolidinyl)phenyl]carbamothioyl}benzamid [German] [ACD/IUPAC Name]
3,5-Dibromo-2-methoxy-N-{[2-(1-pyrrolidinyl)phenyl]carbamothioyl}benzamide [ACD/IUPAC Name]
3,5-Dibromo-2-méthoxy-N-{[2-(1-pyrrolidinyl)phényl]carbamothioyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 3,5-dibromo-2-methoxy-N-[[[2-(1-pyrrolidinyl)phenyl]amino]thioxomethyl]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.692
Molar Refractivity: 118.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.70
ACD/LogD (pH 5.5): 3.89
ACD/BCF (pH 5.5): 339.35
ACD/KOC (pH 5.5): 1314.14
ACD/LogD (pH 7.4): 4.23
ACD/BCF (pH 7.4): 731.48
ACD/KOC (pH 7.4): 2832.66
Polar Surface Area: 86 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 65.9±3.0 dyne/cm
Molar Volume: 309.5±3.0 cm3

Click to predict properties on the Chemicalize site


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