ChemSpider 2D Image | N-{[3-(3,4-Dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-methyl-1-(2-naphthylsulfonyl)prolinamide | C27H28N4O6S

N-{[3-(3,4-Dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-methyl-1-(2-naphthylsulfonyl)prolinamide

  • Molecular FormulaC27H28N4O6S
  • Average mass536.599 Da
  • Monoisotopic mass536.172974 Da
  • ChemSpider ID12936773

More details:

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

2-Pyrrolidinecarboxamide, N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methyl-1-(2-naphthalenylsulfonyl)- [ACD/Index Name]
N-{[3-(3,4-Dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-methyl-1-(2-naphthylsulfonyl)prolinamid [German] [ACD/IUPAC Name]
N-{[3-(3,4-Dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-methyl-1-(2-naphthylsulfonyl)prolinamide [ACD/IUPAC Name]
N-{[3-(3,4-Diméthoxyphényl)-1,2,4-oxadiazol-5-yl]méthyl}-N-méthyl-1-(2-naphtylsulfonyl)prolinamide [French] [ACD/IUPAC Name]
1-(Naphthalene-2-sulfonyl)-pyrrolidine-2-carboxylic acid [3-(3,4-dimethoxy-phenyl)-[1,2,4]oxadiazol-5-ylmethyl]-methyl-amide
N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-methyl-1-(naphthalen-2-ylsulfonyl)prolinamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 750.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.4±3.0 kJ/mol
Flash Point: 407.7±35.7 °C
Index of Refraction: 1.627
Molar Refractivity: 141.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 304.39
ACD/KOC (pH 5.5): 2085.69
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 304.39
ACD/KOC (pH 7.4): 2085.69
Polar Surface Area: 123 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 399.4±3.0 cm3

Click to predict properties on the Chemicalize site


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