ChemSpider 2D Image | (3S)-Tetrahydro-3-furanyl [(2S,3R)-4-{[(4-aminophenyl)sulfonyl](2-methyl-2-propanyl)amino}-1-phenyl-3-(phosphonooxy)-2-butanyl]carbamate | C25H36N3O9PS

(3S)-Tetrahydro-3-furanyl [(2S,3R)-4-{[(4-aminophenyl)sulfonyl](2-methyl-2-propanyl)amino}-1-phenyl-3-(phosphonooxy)-2-butanyl]carbamate

  • Molecular FormulaC25H36N3O9PS
  • Average mass585.607 Da
  • Monoisotopic mass585.190979 Da
  • ChemSpider ID114751783

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(3S)-Tetrahydro-3-furanyl [(2S,3R)-4-{[(4-aminophenyl)sulfonyl](2-methyl-2-propanyl)amino}-1-phenyl-3-(phosphonooxy)-2-butanyl]carbamate [ACD/IUPAC Name]
(3S)-Tetrahydro-3-furanyl-[(2S,3R)-4-{[(4-aminophenyl)sulfonyl](2-methyl-2-propanyl)amino}-1-phenyl-3-(phosphonooxy)-2-butanyl]carbamat [German] [ACD/IUPAC Name]
[(2S,3R)-4-{[(4-Aminophényl)sulfonyl](2-méthyl-2-propanyl)amino}-1-phényl-3-(phosphonooxy)-2-butanyl]carbamate de (3S)-tétrahydro-3-furanyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[(1S,2R)-3-[[(4-aminophenyl)sulfonyl](1,1-dimethylethyl)amino]-1-(phenylmethyl)-2-(phosphonooxy)propyl]-, (3S)-tetrahydro-3-furanyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.612
Molar Refractivity: 144.7±0.4 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 3.18
ACD/LogD (pH 5.5): -1.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 196 Å2
Polarizability: 57.4±0.5 10-24cm3
Surface Tension: 67.5±5.0 dyne/cm
Molar Volume: 416.1±5.0 cm3

Click to predict properties on the Chemicalize site


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