ChemSpider 2D Image | Methyl 2-[({[4-methyl-3-(4-morpholinylsulfonyl)benzoyl]oxy}acetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate | C23H26N2O8S2

Methyl 2-[({[4-methyl-3-(4-morpholinylsulfonyl)benzoyl]oxy}acetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

  • Molecular FormulaC23H26N2O8S2
  • Average mass522.591 Da
  • Monoisotopic mass522.113037 Da
  • ChemSpider ID3389437

More details:

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

2-[(2-{[4-Méthyl-3-(4-morpholinylsulfonyl)benzoyl]oxy}acétyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophène-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
4H-Cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[2-[[4-methyl-3-(4-morpholinylsulfonyl)benzoyl]oxy]acetyl]amino]-, methyl ester [ACD/Index Name]
Methyl 2-[({[4-methyl-3-(4-morpholinylsulfonyl)benzoyl]oxy}acetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate [ACD/IUPAC Name]
Methyl-2-[({[4-methyl-3-(4-morpholinylsulfonyl)benzoyl]oxy}acetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophen-3-carboxylat [German] [ACD/IUPAC Name]

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: 1.619
Molar Refractivity: 127.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 4.58
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 756.70
ACD/KOC (pH 5.5): 4002.53
ACD/LogD (pH 7.4): 4.09
ACD/BCF (pH 7.4): 756.66
ACD/KOC (pH 7.4): 4002.33
Polar Surface Area: 165 Å2
Polarizability: 50.6±0.5 10-24cm3
Surface Tension: 63.2±3.0 dyne/cm
Molar Volume: 363.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement