ChemSpider 2D Image | 3-[({2-[4-(3-Carbamimidoylphenoxy)butoxy]phenyl}carbamoyl)amino]-4-chlorobenzenesulfonyl fluoride | C24H24ClFN4O5S

3-[({2-[4-(3-Carbamimidoylphenoxy)butoxy]phenyl}carbamoyl)amino]-4-chlorobenzenesulfonyl fluoride

  • Molecular FormulaC24H24ClFN4O5S
  • Average mass534.988 Da
  • Monoisotopic mass534.114014 Da
  • ChemSpider ID155082

More details:

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

3-[({2-[4-(3-Carbamimidoylphenoxy)butoxy]phenyl}carbamoyl)amino]-4-chlorbenzolsulfonylfluorid [German] [ACD/IUPAC Name]
3-[({2-[4-(3-Carbamimidoylphenoxy)butoxy]phenyl}carbamoyl)amino]-4-chlorobenzenesulfonyl fluoride [ACD/IUPAC Name]
Benzenesulfonyl fluoride, 3-[[[[2-[4-[3-[(Z)-aminoiminomethyl]phenoxy]butoxy]phenyl]amino]carbonyl]amino]-4-chloro- [ACD/Index Name]
Fluorure de 3-[({2-[4-(3-carbamimidoylphénoxy)butoxy]phényl}carbamoyl)amino]-4-chlorobenzènesulfonyle [French] [ACD/IUPAC Name]
3-(3-(2-(4-(3-Carbamimidoylphenoxy)butoxy)phenyl)ureido)-4-chlorobenzene-1-sulfonyl fluoride
32919-84-9 [RN]
Benzenesulfonyl fluoride, 3-((((2-(4-(3-(aminoiminomethyl)phenoxy)butoxy)phenyl)amino)carbonyl)amino)-4-chloro-
m-(o-(2-Chloro-5-fluorosulfonylphenylureido)phenoxybutoxy)benzamidine

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.622
Molar Refractivity: 133.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 4.76
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 10.16
ACD/KOC (pH 5.5): 49.41
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 10.29
ACD/KOC (pH 7.4): 50.07
Polar Surface Area: 152 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 53.6±7.0 dyne/cm
Molar Volume: 378.6±7.0 cm3

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