ChemSpider 2D Image | 1-Oxo-1-{[4-(1-pyrrolidinylsulfonyl)phenyl]amino}-2-propanyl 2-(2-pyridinyl)-4-quinolinecarboxylate | C28H26N4O5S

1-Oxo-1-{[4-(1-pyrrolidinylsulfonyl)phenyl]amino}-2-propanyl 2-(2-pyridinyl)-4-quinolinecarboxylate

  • Molecular FormulaC28H26N4O5S
  • Average mass530.595 Da
  • Monoisotopic mass530.162415 Da
  • ChemSpider ID4377748

More details:

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

1-Oxo-1-{[4-(1-pyrrolidinylsulfonyl)phenyl]amino}-2-propanyl 2-(2-pyridinyl)-4-quinolinecarboxylate [ACD/IUPAC Name]
1-Oxo-1-{[4-(1-pyrrolidinylsulfonyl)phenyl]amino}-2-propanyl-2-(2-pyridinyl)-4-chinolincarboxylat [German] [ACD/IUPAC Name]
2-(2-Pyridinyl)-4-quinoléinecarboxylate de 1-oxo-1-{[4-(1-pyrrolidinylsulfonyl)phényl]amino}-2-propanyle [French] [ACD/IUPAC Name]
4-Quinolinecarboxylic acid, 2-(2-pyridinyl)-, 1-methyl-2-oxo-2-[[4-(1-pyrrolidinylsulfonyl)phenyl]amino]ethyl ester [ACD/Index Name]
1-{[4-(PYRROLIDINE-1-SULFONYL)PHENYL]CARBAMOYL}ETHYL 2-(PYRIDIN-2-YL)QUINOLINE-4-CARBOXYLATE

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: 1.663
Molar Refractivity: 142.6±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 4.18
ACD/BCF (pH 5.5): 879.75
ACD/KOC (pH 5.5): 4458.22
ACD/LogD (pH 7.4): 4.18
ACD/BCF (pH 7.4): 879.79
ACD/KOC (pH 7.4): 4458.46
Polar Surface Area: 127 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 66.0±3.0 dyne/cm
Molar Volume: 385.1±3.0 cm3

Click to predict properties on the Chemicalize site


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