ChemSpider 2D Image | (4R)-1-{[1-(4-Chlorophenyl)cyclopropyl]carbonyl}-4-[(2-chlorophenyl)sulfonyl]-N-[1-(iminomethyl)cyclopropyl]-L-prolinamide | C25H25Cl2N3O4S

(4R)-1-{[1-(4-Chlorophenyl)cyclopropyl]carbonyl}-4-[(2-chlorophenyl)sulfonyl]-N-[1-(iminomethyl)cyclopropyl]-L-prolinamide

  • Molecular FormulaC25H25Cl2N3O4S
  • Average mass534.455 Da
  • Monoisotopic mass533.094299 Da
  • ChemSpider ID26325583

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R)-1-{[1-(4-Chlorophenyl)cyclopropyl]carbonyl}-4-[(2-chlorophenyl)sulfonyl]-N-[1-(iminomethyl)cyclopropyl]-L-prolinamide [ACD/IUPAC Name]
(4R)-1-{[1-(4-Chlorophényl)cyclopropyl]carbonyl}-4-[(2-chlorophényl)sulfonyl]-N-[1-(iminométhyl)cyclopropyl]-L-prolinamide [French] [ACD/IUPAC Name]
(4R)-1-{[1-(4-Chlorphenyl)cyclopropyl]carbonyl}-4-[(2-chlorphenyl)sulfonyl]-N-[1-(iminomethyl)cyclopropyl]-L-prolinamid [German] [ACD/IUPAC Name]
2-Pyrrolidinecarboxamide, 1-[[1-(4-chlorophenyl)cyclopropyl]carbonyl]-4-[(2-chlorophenyl)sulfonyl]-N-[1-(iminomethyl)cyclopropyl]-, (2S,4R)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.707
Molar Refractivity: 135.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.52
ACD/LogD (pH 5.5): 0.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.98
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 1.28
ACD/KOC (pH 7.4): 12.90
Polar Surface Area: 116 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 64.3±7.0 dyne/cm
Molar Volume: 348.5±7.0 cm3

Click to predict properties on the Chemicalize site


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