ChemSpider 2D Image | N~2~-Formyl-N-[(1R)-1-({[(2S)-1-methoxy-1-oxo-3-phenyl-2-propanyl]oxy}phosphinato)-2-(2-naphthyl)ethyl]-L-valinamide | C28H32N2O7P

N2-Formyl-N-[(1R)-1-({[(2S)-1-methoxy-1-oxo-3-phenyl-2-propanyl]oxy}phosphinato)-2-(2-naphthyl)ethyl]-L-valinamide

  • Molecular FormulaC28H32N2O7P
  • Average mass539.537 Da
  • Monoisotopic mass539.195251 Da
  • ChemSpider ID4451203

  • Charge - Charge

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

Benzenepropanoic acid, α-[[[(1R)-1-[[(2S)-2-(formylamino)-3-methyl-1-oxobutyl]amino]-2-(2-naphthalenyl)ethyl]hydroxyphosphinyl]oxy]-, methyl ester, ion(1-), (αS)- [ACD/Index Name]
N2-Formyl-N-[(1R)-1-({[(2S)-1-methoxy-1-oxo-3-phenyl-2-propanyl]oxy}phosphinato)-2-(2-naphthyl)ethyl]-L-valinamid [German] [ACD/IUPAC Name]
N2-Formyl-N-[(1R)-1-({[(2S)-1-methoxy-1-oxo-3-phenyl-2-propanyl]oxy}phosphinato)-2-(2-naphthyl)ethyl]-L-valinamide [ACD/IUPAC Name]
N2-Formyl-N-[(1R)-1-({[(2S)-1-méthoxy-1-oxo-3-phényl-2-propanyl]oxy}phosphinato)-2-(2-naphtyl)éthyl]-L-valinamide [French] [ACD/IUPAC Name]
METHYL (2S)-[1-((N-FORMYL)-L-VALYL)AMINO-2-(2-NAPHTHYL)ETHYL)HYDROXYPHOSPHINYLOXY]-3-PHENYL PROPANOATE
PP4

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 4.35
ACD/LogD (pH 5.5): -0.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 144 Å2
Polarizability:
Surface Tension:
Molar Volume:

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