ChemSpider 2D Image | (3S,4S)-1-[(2-Chlorophenyl)sulfonyl]-N-(2-iminoethyl)-4-(4-morpholinylcarbonyl)-3-pyrrolidinecarboxamide | C18H23ClN4O5S

(3S,4S)-1-[(2-Chlorophenyl)sulfonyl]-N-(2-iminoethyl)-4-(4-morpholinylcarbonyl)-3-pyrrolidinecarboxamide

  • Molecular FormulaC18H23ClN4O5S
  • Average mass442.917 Da
  • Monoisotopic mass442.107758 Da
  • ChemSpider ID35034813

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4S)-1-[(2-Chlorophenyl)sulfonyl]-N-(2-iminoethyl)-4-(4-morpholinylcarbonyl)-3-pyrrolidinecarboxamide [ACD/IUPAC Name]
(3S,4S)-1-[(2-Chlorophényl)sulfonyl]-N-(2-iminoéthyl)-4-(4-morpholinylcarbonyl)-3-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]
(3S,4S)-1-[(2-Chlorphenyl)sulfonyl]-N-(2-iminoethyl)-4-(4-morpholinylcarbonyl)-3-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
3-Pyrrolidinecarboxamide, 1-[(2-chlorophenyl)sulfonyl]-N-(2-iminoethyl)-4-(4-morpholinylcarbonyl)-, (3S,4S)- [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: 1.668
Molar Refractivity: 108.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.17
ACD/LogD (pH 5.5): -1.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.16
Polar Surface Area: 128 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 63.8±7.0 dyne/cm
Molar Volume: 290.4±7.0 cm3

Click to predict properties on the Chemicalize site


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