ChemSpider 2D Image | (2R,3R)-2,3-Dihydroxy-4-oxo-4-[(2R)-2-phenyl-1-pyrrolidinyl]-N-(2-thienylmethyl)butanamide | C19H22N2O4S

(2R,3R)-2,3-Dihydroxy-4-oxo-4-[(2R)-2-phenyl-1-pyrrolidinyl]-N-(2-thienylmethyl)butanamide

  • Molecular FormulaC19H22N2O4S
  • Average mass374.454 Da
  • Monoisotopic mass374.130035 Da
  • ChemSpider ID25059192

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2R,3R)-2,3-Dihydroxy-4-oxo-4-[(2R)-2-phenyl-1-pyrrolidinyl]-N-(2-thienylmethyl)butanamid [German] [ACD/IUPAC Name]
(2R,3R)-2,3-Dihydroxy-4-oxo-4-[(2R)-2-phenyl-1-pyrrolidinyl]-N-(2-thienylmethyl)butanamide [ACD/IUPAC Name]
(2R,3R)-2,3-Dihydroxy-4-oxo-4-[(2R)-2-phényl-1-pyrrolidinyl]-N-(2-thiénylméthyl)butanamide [French] [ACD/IUPAC Name]
(2r,3r)-2,3-Dihydroxy-4-Oxo-4-[(2r)-2-Phenylpyrrolidin-1-Yl]-N-(Thiophen-2-Ylmethyl)butanamide
1-Pyrrolidinebutanamide, α,β-dihydroxy-γ-oxo-2-phenyl-N-(2-thienylmethyl)-, (αR,βR,2R)- [ACD/Index Name]
Z59

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

Density: 1.4±0.1 g/cm3
Boiling Point: 701.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.8±3.0 kJ/mol
Flash Point: 378.1±32.9 °C
Index of Refraction: 1.635
Molar Refractivity: 99.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 20.64
ACD/KOC (pH 5.5): 303.90
ACD/LogD (pH 7.4): 2.03
ACD/BCF (pH 7.4): 20.64
ACD/KOC (pH 7.4): 303.88
Polar Surface Area: 118 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 65.3±3.0 dyne/cm
Molar Volume: 276.6±3.0 cm3

Click to predict properties on the Chemicalize site


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