ChemSpider 2D Image | 1-{5-Carboxy-2-[4-({[2-(2-hydroxyethoxy)ethyl]carbamothioyl}amino)phenoxy]-3-sulfamoylphenyl}-2H-pyrrolium | C22H25N4O7S2

1-{5-Carboxy-2-[4-({[2-(2-hydroxyethoxy)ethyl]carbamothioyl}amino)phenoxy]-3-sulfamoylphenyl}-2H-pyrrolium

  • Molecular FormulaC22H25N4O7S2
  • Average mass521.586 Da
  • Monoisotopic mass521.115906 Da
  • ChemSpider ID2300527
  • Charge - Charge


More details:






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

1-{5-Carboxy-2-[4-({[2-(2-hydroxyethoxy)ethyl]carbamothioyl}amino)phenoxy]-3-sulfamoylphenyl}-2H-pyrrolium [ACD/IUPAC Name]
1-{5-Carboxy-2-[4-({[2-(2-hydroxyethoxy)ethyl]carbamothioyl}amino)phenoxy]-3-sulfamoylphenyl}-2H-pyrrolium [German] [ACD/IUPAC Name]
1-{5-Carboxy-2-[4-({[2-(2-hydroxyéthoxy)éthyl]carbamothioyl}amino)phénoxy]-3-sulfamoylphényl}-2H-pyrrolium [French] [ACD/IUPAC Name]
2H-Pyrrolium, 1-[3-(aminosulfonyl)-5-carboxy-2-[4-[[[[2-(2-hydroxyethoxy)ethyl]amino]thioxomethyl]amino]phenoxy]phenyl]- [ACD/Index Name]
120750-70-1 [RN]
4-Polyethylene glycol-sulfonylurea-piretanide
Pir-peg
Poly(oxy-1,2-ethanediyl), α-(2-((((4-(2-(aminosulfonyl)-4-carboxy-6-(1H-pyrrol-1-yl)phenoxy)phenyl)amino)thioxomethyl)amino)ethyl)-ω-hydroxy-

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

Density:
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Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 13
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 204 Å2
Polarizability:
Surface Tension:
Molar Volume:

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