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ChemSpider 2D Image | lefradafiban | C23H25N3O6

lefradafiban

  • Molecular FormulaC23H25N3O6
  • Average mass439.461 Da
  • Monoisotopic mass439.174347 Da
  • ChemSpider ID10709340

More details:

Date of deprecation: 11:53, May 7, 2024
Reason for deprecation: Deprecate record:

If you believe this record was deprecated in error, please use the Comment on this record button to contact the ChemSpider team.

Common reasons for deprecation are:
  • Chemically impossible structures (eg. incorrect valence atoms)
  • Lack of any linking data sources
  • Poor depiction of a structure that is already in ChemSpider

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

{5-[({4'-[N'-(Méthoxycarbonyl)carbamimidoyl]-4-biphénylyl}oxy)méthyl]-2-oxo-3-pyrrolidinyl}acétate de méthyle [French] [ACD/IUPAC Name]
{5-[({4'-[N-(Méthoxycarbonyl)carbamimidoyl]-4-biphénylyl}oxy)méthyl]-2-oxo-3-pyrrolidinyl}acétate de méthyle [French] [ACD/IUPAC Name]
3-Pyrrolidineacetic acid, 5-[[[4'-[(Z)-amino[(methoxycarbonyl)imino]methyl][1,1'-biphenyl]-4-yl]oxy]methyl]-2-oxo-, methyl ester [ACD/Index Name]
3-Pyrrolidineacetic acid, 5-[[[4'-[imino[(methoxycarbonyl)amino]methyl][1,1'-biphenyl]-4-yl]oxy]methyl]-2-oxo-, methyl ester [ACD/Index Name]
lefradafiban [INN]
Methyl {5-[({4'-[N'-(methoxycarbonyl)carbamimidoyl]-4-biphenylyl}oxy)methyl]-2-oxo-3-pyrrolidinyl}acetate [ACD/IUPAC Name]
Methyl {5-[({4'-[N-(methoxycarbonyl)carbamimidoyl]-4-biphenylyl}oxy)methyl]-2-oxo-3-pyrrolidinyl}acetate [ACD/IUPAC Name]
Methyl-{5-[({4'-[N'-(methoxycarbonyl)carbamimidoyl]-4-biphenylyl}oxy)methyl]-2-oxo-3-pyrrolidinyl}acetat [German] [ACD/IUPAC Name]
Methyl-{5-[({4'-[N-(methoxycarbonyl)carbamimidoyl]-4-biphenylyl}oxy)methyl]-2-oxo-3-pyrrolidinyl}acetat [German] [ACD/IUPAC Name]
0R4888YXR5
More...

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

Density: 1.3±0.0 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.609
Molar Refractivity: 115.3±0.0 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 0.40
ACD/LogD (pH 5.5): 0.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 29.02
ACD/LogD (pH 7.4): 0.39
ACD/BCF (pH 7.4): 1.15
ACD/KOC (pH 7.4): 38.16
Polar Surface Area: 127 Å2
Polarizability: 45.7±0.0 10-24cm3
Surface Tension: 49.8±0.0 dyne/cm
Molar Volume: 332.8±0.0 cm3

Click to predict properties on the Chemicalize site


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